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/data/big.sdf

http://github.com/rajarshi/cdkr
Unknown | 10629 lines | 10352 code | 277 blank | 0 comment | 0 complexity | bb87c476442d8d6f5c6241a647e13d26 MD5 | raw file
  1. dan001.sdf
  2. MOE2004 3D
  3. 5 4 0 0 0 0 0 0 0 0999 V2000
  4. 0.0470 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  5. -1.9100 -0.0020 0.0020 Br 0 0 0 0 0 0 0 0 0 0 0 0
  6. 0.6200 1.5370 0.6820 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  7. 0.6240 -1.3590 0.9880 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  8. 0.6190 -0.1760 -1.6720 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  9. 1 2 1 0 0 0 0
  10. 1 3 1 0 0 0 0
  11. 1 4 1 0 0 0 0
  12. 1 5 1 0 0 0 0
  13. M END
  14. $$$$
  15. dan002.sdf
  16. MOE2004 3D
  17. 5 4 0 0 0 0 0 0 0 0999 V2000
  18. -1.7000 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  19. 0.0500 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  20. 0.5500 0.4580 1.1740 F 0 0 0 0 0 0 0 0 0 0 0 0
  21. 0.5500 -1.2450 -0.1900 F 0 0 0 0 0 0 0 0 0 0 0 0
  22. 0.5500 0.7880 -0.9830 F 0 0 0 0 0 0 0 0 0 0 0 0
  23. 1 2 1 0 0 0 0
  24. 2 3 1 0 0 0 0
  25. 2 4 1 0 0 0 0
  26. 2 5 1 0 0 0 0
  27. M END
  28. $$$$
  29. dan003.sdf
  30. MOE2004 3D
  31. 5 4 0 0 0 0 0 0 0 0999 V2000
  32. 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  33. -1.6220 -0.7250 -0.0370 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  34. 1.2250 -1.2830 -0.1080 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  35. 0.1840 1.1110 -1.3750 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  36. 0.2140 0.8970 1.5190 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  37. 1 2 1 0 0 0 0
  38. 1 3 1 0 0 0 0
  39. 1 4 1 0 0 0 0
  40. 1 5 1 0 0 0 0
  41. M END
  42. $$$$
  43. dan004.sdf
  44. MOE2004 3D
  45. 5 4 0 0 0 0 0 0 0 0999 V2000
  46. 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  47. -0.3610 1.1390 -0.6320 F 0 0 0 0 0 0 0 0 0 0 0 0
  48. 0.4950 -0.8780 -0.9010 F 0 0 0 0 0 0 0 0 0 0 0 0
  49. 0.9460 0.2780 0.9240 F 0 0 0 0 0 0 0 0 0 0 0 0
  50. -1.0800 -0.5400 0.6090 F 0 0 0 0 0 0 0 0 0 0 0 0
  51. 1 2 1 0 0 0 0
  52. 1 3 1 0 0 0 0
  53. 1 4 1 0 0 0 0
  54. 1 5 1 0 0 0 0
  55. M END
  56. $$$$
  57. dan005.sdf
  58. MOE2004 3D
  59. 5 4 0 0 0 0 0 0 0 0999 V2000
  60. 1.8200 0.3910 -0.4400 Br 0 0 0 0 0 0 0 0 0 0 0 0
  61. 0.0000 0.0000 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0
  62. 0.0000 0.0000 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0
  63. -1.2490 1.3810 -0.4400 Br 0 0 0 0 0 0 0 0 0 0 0 0
  64. -0.5710 -1.7720 -0.4400 Br 0 0 0 0 0 0 0 0 0 0 0 0
  65. 1 2 1 0 0 0 0
  66. 2 3 1 0 0 0 0
  67. 2 4 1 0 0 0 0
  68. 2 5 1 0 0 0 0
  69. M END
  70. $$$$
  71. dan006.sdf
  72. MOE2004 3D
  73. 5 4 0 0 0 0 0 0 0 0999 V2000
  74. 0.0680 0.0000 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  75. 0.1570 0.0000 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0
  76. -1.6310 0.0000 -0.3910 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  77. 0.7040 1.0900 -0.4250 F 0 0 0 0 0 0 0 0 0 0 0 0
  78. 0.7040 -1.0900 -0.4250 F 0 0 0 0 0 0 0 0 0 0 0 0
  79. 1 2 1 0 0 0 0
  80. 1 3 1 0 0 0 0
  81. 1 4 1 0 0 0 0
  82. 1 5 1 0 0 0 0
  83. M END
  84. $$$$
  85. dan007.sdf
  86. MOE2004 3D
  87. 5 4 0 0 0 0 0 0 0 0999 V2000
  88. 0.0000 -0.0800 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  89. 0.0000 -0.1770 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  90. -1.4580 0.7920 -0.4070 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  91. 1.4580 0.7920 -0.4070 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  92. 0.0000 -1.3270 -0.4520 F 0 0 0 0 0 0 0 0 0 0 0 0
  93. 1 2 1 0 0 0 0
  94. 1 3 1 0 0 0 0
  95. 1 4 1 0 0 0 0
  96. 1 5 1 0 0 0 0
  97. M END
  98. $$$$
  99. dan008.sdf
  100. MOE2004 3D
  101. 5 4 0 0 0 0 0 0 0 0999 V2000
  102. 0.0000 0.0000 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0
  103. 0.0000 0.0000 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0
  104. 1.5710 -0.6010 -0.4420 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  105. -1.3060 -1.0600 -0.4420 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  106. -0.2650 1.6610 -0.4420 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  107. 1 2 1 0 0 0 0
  108. 1 3 1 0 0 0 0
  109. 1 4 1 0 0 0 0
  110. 1 5 1 0 0 0 0
  111. M END
  112. $$$$
  113. dan009.sdf
  114. MOE2004 3D
  115. 5 4 0 0 0 0 0 0 0 0999 V2000
  116. 0.0000 0.0000 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  117. 0.0000 0.0000 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0
  118. 0.7950 0.9820 0.4140 F 0 0 0 0 0 0 0 0 0 0 0 0
  119. -1.2480 0.1980 0.4140 F 0 0 0 0 0 0 0 0 0 0 0 0
  120. 0.4530 -1.1800 0.4140 F 0 0 0 0 0 0 0 0 0 0 0 0
  121. 1 2 1 0 0 0 0
  122. 1 3 1 0 0 0 0
  123. 1 4 1 0 0 0 0
  124. 1 5 1 0 0 0 0
  125. M END
  126. $$$$
  127. dan010.sdf
  128. MOE2004 3D
  129. 5 4 0 0 0 0 0 0 0 0999 V2000
  130. 0.0000 -0.1720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  131. 0.0000 -0.7960 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  132. 0.0000 -0.7960 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  133. -1.6150 0.8820 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
  134. 1.6150 0.8820 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
  135. 1 2 1 0 0 0 0
  136. 1 3 1 0 0 0 0
  137. 1 4 1 0 0 0 0
  138. 1 5 1 0 0 0 0
  139. M END
  140. $$$$
  141. dan011.sdf
  142. MOE2004 3D
  143. 5 4 0 0 0 0 0 0 0 0999 V2000
  144. 0.0000 -0.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  145. 0.0000 -0.7780 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  146. 0.0000 -0.7780 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  147. -1.4590 0.8530 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  148. 1.4590 0.8530 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  149. 1 2 1 0 0 0 0
  150. 1 3 1 0 0 0 0
  151. 1 4 1 0 0 0 0
  152. 1 5 1 0 0 0 0
  153. M END
  154. $$$$
  155. dan012.sdf
  156. MOE2004 3D
  157. 5 4 0 0 0 0 0 0 0 0999 V2000
  158. 0.0000 0.0780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  159. 0.0000 0.6910 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0
  160. 0.0000 0.6910 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0
  161. -1.0910 -0.7300 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  162. 1.0910 -0.7300 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  163. 1 2 1 0 0 0 0
  164. 1 3 1 0 0 0 0
  165. 1 4 1 0 0 0 0
  166. 1 5 1 0 0 0 0
  167. M END
  168. $$$$
  169. dan013.sdf
  170. MOE2004 3D
  171. 5 4 0 0 0 0 0 0 0 0999 V2000
  172. 0.0000 0.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  173. 0.0000 0.8970 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0
  174. 0.0000 0.8970 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0
  175. -1.7110 -1.0270 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0
  176. 1.7110 -1.0270 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0
  177. 1 2 1 0 0 0 0
  178. 1 3 1 0 0 0 0
  179. 1 4 1 0 0 0 0
  180. 1 5 1 0 0 0 0
  181. M END
  182. $$$$
  183. dan014.sdf
  184. MOE2004 3D
  185. 4 3 0 0 0 0 0 0 0 0999 V2000
  186. 1.2120 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  187. -0.0120 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  188. -0.6000 -0.8370 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
  189. -0.6000 0.8370 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
  190. 1 2 2 0 0 0 0
  191. 2 3 1 0 0 0 0
  192. 2 4 1 0 0 0 0
  193. M END
  194. $$$$
  195. dan015.sdf
  196. MOE2004 2D
  197. 5 4 0 0 0 0 0 0 0 0999 V2000
  198. -0.2540 -0.3390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  199. -0.1500 -1.4350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  200. -1.2970 0.2900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  201. 0.9470 0.2610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  202. 0.7550 1.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  203. 1 2 1 0 0 0 0
  204. 1 3 2 0 0 0 0
  205. 1 4 1 0 0 0 0
  206. 4 5 1 0 0 0 0
  207. M END
  208. $$$$
  209. dan016.sdf
  210. MOE2004 3D
  211. 5 4 0 0 0 0 0 0 0 0999 V2000
  212. 0.1800 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  213. 0.5230 0.9600 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0
  214. 0.5230 -0.1400 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0
  215. 0.5230 -0.8200 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0
  216. -1.7490 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
  217. 1 2 1 0 0 0 0
  218. 1 3 1 0 0 0 0
  219. 1 4 1 0 0 0 0
  220. 1 5 1 0 0 0 0
  221. M END
  222. $$$$
  223. dan017.sdf
  224. MOE2004 3D
  225. 5 4 0 0 0 0 0 0 0 0999 V2000
  226. -0.1410 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  227. -0.4960 0.2990 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0
  228. -0.4960 -1.0060 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0
  229. -0.4960 0.7070 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0
  230. 1.6300 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  231. 1 2 1 0 0 0 0
  232. 1 3 1 0 0 0 0
  233. 1 4 1 0 0 0 0
  234. 1 5 1 0 0 0 0
  235. M END
  236. $$$$
  237. dan018.sdf
  238. MOE2004 3D
  239. 5 4 0 0 0 0 0 0 0 0999 V2000
  240. -0.0620 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  241. -0.4120 -1.0080 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0
  242. -0.4120 0.7070 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0
  243. -0.4120 0.3000 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0
  244. 1.2970 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  245. 1 2 1 0 0 0 0
  246. 1 3 1 0 0 0 0
  247. 1 4 1 0 0 0 0
  248. 1 5 1 0 0 0 0
  249. M END
  250. $$$$
  251. dan019.sdf
  252. MOE2004 3D
  253. 5 4 0 0 0 0 0 0 0 0999 V2000
  254. -0.1930 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  255. -0.5790 0.8500 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0
  256. -0.5800 0.0680 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0
  257. -0.5790 -0.9180 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0
  258. 1.9310 0.0000 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0
  259. 1 2 1 0 0 0 0
  260. 1 3 1 0 0 0 0
  261. 1 4 1 0 0 0 0
  262. 1 5 1 0 0 0 0
  263. M END
  264. $$$$
  265. dan020.sdf
  266. MOE2004 3D
  267. 6 5 0 0 0 0 0 0 0 0999 V2000
  268. -0.3400 0.0310 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0
  269. -0.6960 -0.7290 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0
  270. -0.7170 -0.1890 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0
  271. -0.6970 1.0140 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0
  272. 1.0780 0.0310 -0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0
  273. 1.3720 -0.1590 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0
  274. 1 2 1 0 0 0 0
  275. 1 3 1 0 0 0 0
  276. 1 4 1 0 0 0 0
  277. 1 5 1 0 0 0 0
  278. 5 6 1 0 0 0 0
  279. M END
  280. $$$$
  281. dan021.sdf
  282. MOE2004 3D
  283. 6 5 0 0 0 0 0 0 0 0999 V2000
  284. -0.4410 0.0370 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0
  285. -0.8120 0.2090 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0
  286. -0.8130 0.8280 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
  287. -0.8130 -0.9270 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0
  288. 1.3630 0.0370 0.2190 S 0 0 0 0 0 0 0 0 0 0 0 0
  289. 1.5160 -0.1850 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  290. 1 2 1 0 0 0 0
  291. 1 3 1 0 0 0 0
  292. 1 4 1 0 0 0 0
  293. 1 5 1 0 0 0 0
  294. 5 6 1 0 0 0 0
  295. M END
  296. $$$$
  297. dan022.sdf
  298. MOE2004 3D
  299. 8 7 0 0 0 0 0 0 0 0999 V2000
  300. -0.7310 0.0000 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0
  301. 0.7940 0.0000 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0
  302. -1.4630 -1.4580 0.6110 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  303. -1.4630 1.4580 0.6110 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  304. -1.0330 0.0000 -1.4590 F 0 0 0 0 0 0 0 0 0 0 0 0
  305. 1.1600 -0.0010 1.3600 F 0 0 0 0 0 0 0 0 0 0 0 0
  306. 1.3680 -1.0910 -0.5240 F 0 0 0 0 0 0 0 0 0 0 0 0
  307. 1.3680 1.0920 -0.5220 F 0 0 0 0 0 0 0 0 0 0 0 0
  308. 1 2 1 0 0 0 0
  309. 1 3 1 0 0 0 0
  310. 1 4 1 0 0 0 0
  311. 1 5 1 0 0 0 0
  312. 2 6 1 0 0 0 0
  313. 2 7 1 0 0 0 0
  314. 2 8 1 0 0 0 0
  315. M END
  316. $$$$
  317. dan023.sdf
  318. MOE2004 3D
  319. 8 7 0 0 0 0 0 0 0 0999 V2000
  320. 0.7630 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  321. -0.7630 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  322. -1.2660 -0.7000 1.0510 F 0 0 0 0 0 0 0 0 0 0 0 0
  323. -1.2670 1.2600 0.0800 F 0 0 0 0 0 0 0 0 0 0 0 0
  324. -1.2670 -0.5610 -1.1320 F 0 0 0 0 0 0 0 0 0 0 0 0
  325. 1.2670 0.5600 1.1320 F 0 0 0 0 0 0 0 0 0 0 0 0
  326. 1.2670 -1.2600 -0.0810 F 0 0 0 0 0 0 0 0 0 0 0 0
  327. 1.2670 0.7010 -1.0510 F 0 0 0 0 0 0 0 0 0 0 0 0
  328. 1 2 1 0 0 0 0
  329. 1 6 1 0 0 0 0
  330. 1 7 1 0 0 0 0
  331. 1 8 1 0 0 0 0
  332. 2 3 1 0 0 0 0
  333. 2 4 1 0 0 0 0
  334. 2 5 1 0 0 0 0
  335. M END
  336. $$$$
  337. dan024.sdf
  338. MOE2004 3D
  339. 8 7 0 0 0 0 0 0 0 0999 V2000
  340. -0.7650 0.0000 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0
  341. 0.6810 0.0000 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0
  342. 0.7040 0.0000 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0
  343. 1.5560 1.4570 -0.2470 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  344. 1.5560 -1.4570 -0.2470 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  345. -1.4380 1.0890 0.2660 F 0 0 0 0 0 0 0 0 0 0 0 0
  346. -0.8570 0.0000 -1.5430 F 0 0 0 0 0 0 0 0 0 0 0 0
  347. -1.4370 -1.0900 0.2660 F 0 0 0 0 0 0 0 0 0 0 0 0
  348. 1 2 1 0 0 0 0
  349. 1 6 1 0 0 0 0
  350. 1 7 1 0 0 0 0
  351. 1 8 1 0 0 0 0
  352. 2 3 1 0 0 0 0
  353. 2 4 1 0 0 0 0
  354. 2 5 1 0 0 0 0
  355. M END
  356. $$$$
  357. dan025.sdf
  358. MOE2004 2D
  359. 6 5 0 0 0 0 0 0 0 0999 V2000
  360. 0.5480 -0.4450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  361. 0.5390 -1.5280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  362. -0.5650 0.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  363. -0.5630 2.0170 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  364. -2.1090 -0.4940 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  365. 2.1490 0.1570 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  366. 1 2 1 0 0 0 0
  367. 1 3 2 0 0 0 0
  368. 1 6 1 0 0 0 0
  369. 3 4 1 0 0 0 0
  370. 3 5 1 0 0 0 0
  371. M END
  372. $$$$
  373. dan026.sdf
  374. MOE2004 3D
  375. 7 6 0 0 0 0 0 0 0 0999 V2000
  376. -0.5030 0.0000 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0
  377. 0.8170 0.0000 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0
  378. 0.7640 -0.0010 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0
  379. 1.9220 0.0000 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0
  380. -1.8170 -0.0020 0.9140 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  381. -0.5910 1.4620 -1.2770 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  382. -0.5910 -1.4590 -1.2810 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  383. 1 2 1 0 0 0 0
  384. 1 5 1 0 0 0 0
  385. 1 6 1 0 0 0 0
  386. 1 7 1 0 0 0 0
  387. 2 3 1 0 0 0 0
  388. 2 4 2 0 0 0 0
  389. M END
  390. $$$$
  391. dan027.sdf
  392. MOE2004 3D
  393. 8 7 0 0 0 0 0 0 0 0999 V2000
  394. 0.7290 0.0000 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0
  395. 0.7320 0.0000 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
  396. -0.7330 0.0000 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
  397. -1.6190 1.4410 -0.3960 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  398. -1.6200 -1.4400 -0.4000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  399. -0.8130 -0.0020 1.9950 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  400. 1.6620 1.4510 0.1710 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  401. 1.6620 -1.4500 0.1720 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  402. 1 2 1 0 0 0 0
  403. 1 3 1 0 0 0 0
  404. 1 7 1 0 0 0 0
  405. 1 8 1 0 0 0 0
  406. 3 4 1 0 0 0 0
  407. 3 5 1 0 0 0 0
  408. 3 6 1 0 0 0 0
  409. M END
  410. $$$$
  411. dan028.sdf
  412. MOE2004 3D
  413. 8 7 0 0 0 0 0 0 0 0999 V2000
  414. 0.7340 0.0000 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0
  415. 0.8300 0.0000 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0
  416. -0.7230 0.0000 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0
  417. -1.3770 1.0910 -0.2960 F 0 0 0 0 0 0 0 0 0 0 0 0
  418. -1.3770 -1.0920 -0.2940 F 0 0 0 0 0 0 0 0 0 0 0 0
  419. -0.8570 0.0010 1.5320 F 0 0 0 0 0 0 0 0 0 0 0 0
  420. 1.3850 1.0910 0.2370 F 0 0 0 0 0 0 0 0 0 0 0 0
  421. 1.3850 -1.0910 0.2370 F 0 0 0 0 0 0 0 0 0 0 0 0
  422. 1 2 1 0 0 0 0
  423. 1 3 1 0 0 0 0
  424. 1 7 1 0 0 0 0
  425. 1 8 1 0 0 0 0
  426. 3 4 1 0 0 0 0
  427. 3 5 1 0 0 0 0
  428. 3 6 1 0 0 0 0
  429. M END
  430. $$$$
  431. dan029.sdf
  432. MOE2004 3D
  433. 8 7 0 0 0 0 0 0 0 0999 V2000
  434. -0.6310 0.4170 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  435. -0.6520 1.0980 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0
  436. 0.6310 -0.4170 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0
  437. 0.6520 -1.0990 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0
  438. -2.2080 -0.7110 -0.3750 Br 0 0 0 0 0 0 0 0 0 0 0 0
  439. -0.8320 1.5690 1.4470 Br 0 0 0 0 0 0 0 0 0 0 0 0
  440. 0.8320 -1.5680 1.4480 Br 0 0 0 0 0 0 0 0 0 0 0 0
  441. 2.2080 0.7100 -0.3750 Br 0 0 0 0 0 0 0 0 0 0 0 0
  442. 1 2 1 0 0 0 0
  443. 1 3 1 0 0 0 0
  444. 1 5 1 0 0 0 0
  445. 1 6 1 0 0 0 0
  446. 3 4 1 0 0 0 0
  447. 3 7 1 0 0 0 0
  448. 3 8 1 0 0 0 0
  449. M END
  450. $$$$
  451. dan030.sdf
  452. MOE2004 3D
  453. 8 7 0 0 0 0 0 0 0 0999 V2000
  454. -0.6130 0.0000 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0
  455. 0.6040 0.0000 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0
  456. 0.5980 -0.8820 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0
  457. 0.5980 0.8820 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0
  458. -0.6340 -1.4580 1.4280 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  459. -0.6350 1.4600 1.4250 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  460. -2.1020 -0.0020 -0.5990 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  461. 2.1840 0.0000 0.2960 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  462. 1 2 1 0 0 0 0
  463. 1 5 1 0 0 0 0
  464. 1 6 1 0 0 0 0
  465. 1 7 1 0 0 0 0
  466. 2 3 1 0 0 0 0
  467. 2 4 1 0 0 0 0
  468. 2 8 1 0 0 0 0
  469. M END
  470. $$$$
  471. dan031.sdf
  472. MOE2004 3D
  473. 8 7 0 0 0 0 0 0 0 0999 V2000
  474. -0.6720 0.3770 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0
  475. -0.7330 1.0250 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0
  476. 0.6720 -0.3770 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0
  477. 0.7330 -1.0250 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0
  478. -0.8990 1.4330 -1.3200 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  479. -2.0520 -0.7510 0.2290 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  480. 0.8990 -1.4340 -1.3200 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  481. 2.0530 0.7510 0.2290 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  482. 1 2 1 0 0 0 0
  483. 1 3 1 0 0 0 0
  484. 1 5 1 0 0 0 0
  485. 1 6 1 0 0 0 0
  486. 3 4 1 0 0 0 0
  487. 3 7 1 0 0 0 0
  488. 3 8 1 0 0 0 0
  489. M END
  490. $$$$
  491. dan032.sdf
  492. MOE2004 2D
  493. 6 5 0 0 0 0 0 0 0 0999 V2000
  494. 0.0010 0.7050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  495. -0.9300 1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  496. 0.9350 1.2540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  497. -0.0010 -0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  498. 1.1690 -1.2970 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  499. -1.1730 -1.2930 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  500. 1 2 1 0 0 0 0
  501. 1 3 1 0 0 0 0
  502. 1 4 2 0 0 0 0
  503. 4 5 1 0 0 0 0
  504. 4 6 1 0 0 0 0
  505. M END
  506. $$$$
  507. dan033.sdf
  508. MOE2004 3D
  509. 8 7 0 0 0 0 0 0 0 0999 V2000
  510. 0.7000 -0.2950 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0
  511. 0.8580 -0.9610 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0
  512. -0.7000 0.2950 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0
  513. -0.8580 0.9610 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0
  514. -0.9260 1.0020 -1.0780 F 0 0 0 0 0 0 0 0 0 0 0 0
  515. -1.6300 -0.6960 0.1010 F 0 0 0 0 0 0 0 0 0 0 0 0
  516. 0.9270 -1.0030 -1.0770 F 0 0 0 0 0 0 0 0 0 0 0 0
  517. 1.6300 0.6960 0.1010 F 0 0 0 0 0 0 0 0 0 0 0 0
  518. 1 2 1 0 0 0 0
  519. 1 3 1 0 0 0 0
  520. 1 7 1 0 0 0 0
  521. 1 8 1 0 0 0 0
  522. 3 4 1 0 0 0 0
  523. 3 5 1 0 0 0 0
  524. 3 6 1 0 0 0 0
  525. M END
  526. $$$$
  527. dan034.sdf
  528. MOE2004 2D
  529. 6 5 0 0 0 0 0 0 0 0999 V2000
  530. -0.6720 0.3470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  531. -0.6110 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  532. -1.6590 -0.1010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  533. 0.4220 -0.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  534. 0.3670 -1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  535. 2.1530 0.2400 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
  536. 1 2 1 0 0 0 0
  537. 1 3 1 0 0 0 0
  538. 1 4 2 0 0 0 0
  539. 4 5 1 0 0 0 0
  540. 4 6 1 0 0 0 0
  541. M END
  542. $$$$
  543. dan035.sdf
  544. MOE2004 3D
  545. 7 6 0 0 0 0 0 0 0 0999 V2000
  546. 0.3930 -0.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  547. 0.1300 -1.1240 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0
  548. 0.1390 -1.1170 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0
  549. 1.4730 -0.3740 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
  550. -0.3330 0.7690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  551. 0.2620 1.8410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  552. -2.0640 0.5570 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  553. 1 2 1 0 0 0 0
  554. 1 3 1 0 0 0 0
  555. 1 4 1 0 0 0 0
  556. 1 5 1 0 0 0 0
  557. 5 6 2 0 0 0 0
  558. 5 7 1 0 0 0 0
  559. M END
  560. $$$$
  561. dan036.sdf
  562. MOE2004 3D
  563. 8 7 0 0 0 0 0 0 0 0999 V2000
  564. 0.0000 0.0000 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0
  565. -0.7230 0.7080 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0
  566. 0.9760 0.2720 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0
  567. -0.2510 -0.9810 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0
  568. 0.0000 0.0000 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0
  569. -0.4160 -1.6220 1.3130 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  570. 1.6120 0.4520 1.3130 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  571. -1.1980 1.1710 1.3130 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  572. 1 2 1 0 0 0 0
  573. 1 3 1 0 0 0 0
  574. 1 4 1 0 0 0 0
  575. 1 5 1 0 0 0 0
  576. 5 6 1 0 0 0 0
  577. 5 7 1 0 0 0 0
  578. 5 8 1 0 0 0 0
  579. M END
  580. $$$$
  581. dan037.sdf
  582. MOE2004 3D
  583. 8 7 0 0 0 0 0 0 0 0999 V2000
  584. -0.5740 0.2910 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0
  585. -0.4420 0.2710 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
  586. 0.5760 -0.4240 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0
  587. 0.5020 -0.3340 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
  588. 0.5850 -1.4890 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0
  589. 2.1670 0.2220 -0.1500 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  590. -2.1110 -0.5370 -0.0090 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  591. -0.7020 1.9990 0.1310 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  592. 1 2 1 0 0 0 0
  593. 1 3 1 0 0 0 0
  594. 1 7 1 0 0 0 0
  595. 1 8 1 0 0 0 0
  596. 3 4 1 0 0 0 0
  597. 3 5 1 0 0 0 0
  598. 3 6 1 0 0 0 0
  599. M END
  600. $$$$
  601. dan038.sdf
  602. MOE2004 2D
  603. 6 5 0 0 0 0 0 0 0 0999 V2000
  604. -0.6380 -0.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  605. -0.6570 -1.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  606. -1.5810 0.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  607. 0.5210 0.3490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  608. 0.6590 1.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  609. 1.6960 -0.3030 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  610. 1 2 1 0 0 0 0
  611. 1 3 1 0 0 0 0
  612. 1 4 2 0 0 0 0
  613. 4 5 1 0 0 0 0
  614. 4 6 1 0 0 0 0
  615. M END
  616. $$$$
  617. dan039.sdf
  618. MOE2004 3D
  619. 8 7 0 0 0 0 0 0 0 0999 V2000
  620. -0.7930 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  621. -1.1830 0.8830 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0
  622. -1.1830 0.0040 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0
  623. -1.1830 -0.8870 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0
  624. 0.7180 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  625. 1.2080 -1.0970 0.6270 F 0 0 0 0 0 0 0 0 0 0 0 0
  626. 1.2080 0.0050 -1.2640 F 0 0 0 0 0 0 0 0 0 0 0 0
  627. 1.2080 1.0920 0.6360 F 0 0 0 0 0 0 0 0 0 0 0 0
  628. 1 2 1 0 0 0 0
  629. 1 3 1 0 0 0 0
  630. 1 4 1 0 0 0 0
  631. 1 5 1 0 0 0 0
  632. 5 6 1 0 0 0 0
  633. 5 7 1 0 0 0 0
  634. 5 8 1 0 0 0 0
  635. M END
  636. $$$$
  637. dan040.sdf
  638. MOE2004 3D
  639. 8 7 0 0 0 0 0 0 0 0999 V2000
  640. 0.0000 -0.7910 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
  641. 0.0000 -0.7760 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0
  642. 0.8830 -1.3530 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
  643. -0.8830 -1.3530 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
  644. 0.0000 0.6060 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0
  645. 0.0000 0.5810 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
  646. -1.6120 1.5430 -0.1940 Br 0 0 0 0 0 0 0 0 0 0 0 0
  647. 1.6120 1.5440 -0.1940 Br 0 0 0 0 0 0 0 0 0 0 0 0
  648. 1 2 1 0 0 0 0
  649. 1 3 1 0 0 0 0
  650. 1 4 1 0 0 0 0
  651. 1 5 1 0 0 0 0
  652. 5 6 1 0 0 0 0
  653. 5 7 1 0 0 0 0
  654. 5 8 1 0 0 0 0
  655. M END
  656. $$$$
  657. dan041.sdf
  658. MOE2004 3D
  659. 8 7 0 0 0 0 0 0 0 0999 V2000
  660. 0.6320 -0.1580 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0
  661. 0.4510 -0.0250 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0
  662. 1.1930 -1.0840 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  663. -0.6320 -0.1580 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0
  664. -0.4510 -0.0240 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0
  665. -1.1930 -1.0840 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  666. -1.8370 1.2660 0.1420 Br 0 0 0 0 0 0 0 0 0 0 0 0
  667. 1.8370 1.2660 -0.1420 Br 0 0 0 0 0 0 0 0 0 0 0 0
  668. 1 2 1 0 0 0 0
  669. 1 3 1 0 0 0 0
  670. 1 4 1 0 0 0 0
  671. 1 8 1 0 0 0 0
  672. 4 5 1 0 0 0 0
  673. 4 6 1 0 0 0 0
  674. 4 7 1 0 0 0 0
  675. M END
  676. $$$$
  677. dan042.sdf
  678. MOE2004 3D
  679. 8 7 0 0 0 0 0 0 0 0999 V2000
  680. 0.0000 -0.6380 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0
  681. 0.0000 -0.6270 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0
  682. 0.0000 0.7890 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0
  683. -0.0020 1.5010 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0
  684. 0.8840 1.0130 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0
  685. -0.8820 1.0120 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0
  686. 1.4550 -1.5250 -0.2030 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  687. -1.4560 -1.5250 -0.2030 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  688. 1 2 1 0 0 0 0
  689. 1 3 1 0 0 0 0
  690. 1 7 1 0 0 0 0
  691. 1 8 1 0 0 0 0
  692. 3 4 1 0 0 0 0
  693. 3 5 1 0 0 0 0
  694. 3 6 1 0 0 0 0
  695. M END
  696. $$$$
  697. dan043.sdf
  698. MOE2004 3D
  699. 8 7 0 0 0 0 0 0 0 0999 V2000
  700. 0.6710 -0.1260 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0
  701. 0.5460 -0.0750 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  702. 1.2210 -1.0410 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0
  703. -0.6710 -0.1260 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0
  704. -0.5460 -0.0750 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  705. -1.2210 -1.0410 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0
  706. -1.6990 1.2420 0.1420 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  707. 1.6990 1.2420 -0.1420 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  708. 1 2 1 0 0 0 0
  709. 1 3 1 0 0 0 0
  710. 1 4 1 0 0 0 0
  711. 1 8 1 0 0 0 0
  712. 4 5 1 0 0 0 0
  713. 4 6 1 0 0 0 0
  714. 4 7 1 0 0 0 0
  715. M END
  716. $$$$
  717. dan044.sdf
  718. MOE2004 3D
  719. 8 7 0 0 0 0 0 0 0 0999 V2000
  720. 0.7510 0.0000 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
  721. 0.7830 0.0000 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0
  722. 1.2770 0.8920 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  723. 1.2770 -0.8920 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0
  724. -0.6810 0.0000 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0
  725. -0.7600 0.0000 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0
  726. -1.3240 -1.0900 -0.2170 F 0 0 0 0 0 0 0 0 0 0 0 0
  727. -1.3240 1.0900 -0.2170 F 0 0 0 0 0 0 0 0 0 0 0 0
  728. 1 2 1 0 0 0 0
  729. 1 3 1 0 0 0 0
  730. 1 4 1 0 0 0 0
  731. 1 5 1 0 0 0 0
  732. 5 6 1 0 0 0 0
  733. 5 7 1 0 0 0 0
  734. 5 8 1 0 0 0 0
  735. M END
  736. $$$$
  737. dan045.sdf
  738. MOE2004 3D
  739. 8 7 0 0 0 0 0 0 0 0999 V2000
  740. 0.6840 -0.0630 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0
  741. 0.6120 0.0520 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0
  742. 1.2340 -0.9770 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
  743. -0.6840 -0.0630 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0
  744. -0.6110 0.0520 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0
  745. -1.2330 -0.9770 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
  746. -1.4050 0.9880 0.1570 F 0 0 0 0 0 0 0 0 0 0 0 0
  747. 1.4050 0.9880 -0.1570 F 0 0 0 0 0 0 0 0 0 0 0 0
  748. 1 2 1 0 0 0 0
  749. 1 3 1 0 0 0 0
  750. 1 4 1 0 0 0 0
  751. 1 8 1 0 0 0 0
  752. 4 5 1 0 0 0 0
  753. 4 6 1 0 0 0 0
  754. 4 7 1 0 0 0 0
  755. M END
  756. $$$$
  757. dan046.sdf
  758. MOE2004 3D
  759. 8 7 0 0 0 0 0 0 0 0999 V2000
  760. -0.7260 0.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  761. -1.0220 1.3720 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
  762. -1.1280 -0.1510 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
  763. -1.1290 -0.1600 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  764. 0.7730 0.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  765. 1.5250 1.1850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  766. 1.2110 -1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  767. 0.4960 -1.7270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  768. 1 2 1 0 0 0 0
  769. 1 3 1 0 0 0 0
  770. 1 4 1 0 0 0 0
  771. 1 5 1 0 0 0 0
  772. 5 6 2 0 0 0 0
  773. 5 7 1 0 0 0 0
  774. 7 8 1 0 0 0 0
  775. M END
  776. $$$$
  777. dan047.sdf
  778. MOE2004 3D
  779. 8 7 0 0 0 0 0 0 0 0999 V2000
  780. -1.0350 -0.1210 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  781. -0.9800 0.9720 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
  782. -1.5930 -0.4720 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0
  783. -1.5720 -0.4230 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
  784. 0.2480 -0.7570 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  785. 1.3450 0.0480 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  786. 1.0940 1.1200 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  787. 2.4940 -0.3670 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  788. 1 2 1 0 0 0 0
  789. 1 3 1 0 0 0 0
  790. 1 4 1 0 0 0 0
  791. 1 5 1 0 0 0 0
  792. 5 6 1 0 0 0 0
  793. 6 7 1 0 0 0 0
  794. 6 8 2 0 0 0 0
  795. M END
  796. $$$$
  797. dan048.sdf
  798. MOE2004 3D
  799. 8 7 0 0 0 0 0 0 0 0999 V2000
  800. -0.6550 0.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  801. -0.3200 1.5030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  802. -1.2920 0.3150 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0
  803. -1.2930 0.3140 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0
  804. 0.4710 -0.5520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  805. 0.4440 -1.1850 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0
  806. 0.4440 -1.1850 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0
  807. 2.2000 0.3280 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
  808. 1 2 1 0 0 0 0
  809. 1 3 1 0 0 0 0
  810. 1 4 1 0 0 0 0
  811. 1 5 1 0 0 0 0
  812. 5 6 1 0 0 0 0
  813. 5 7 1 0 0 0 0
  814. 5 8 1 0 0 0 0
  815. M END
  816. $$$$
  817. dan049.sdf
  818. MOE2004 3D
  819. 8 7 0 0 0 0 0 0 0 0999 V2000
  820. -0.6590 0.4410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  821. -0.3650 1.4960 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  822. -1.2870 0.2680 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  823. -1.2880 0.2670 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  824. 0.5210 -0.5170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  825. 0.5030 -1.1570 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  826. 0.5040 -1.1570 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0
  827. 2.0700 0.3590 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  828. 1 2 1 0 0 0 0
  829. 1 3 1 0 0 0 0
  830. 1 4 1 0 0 0 0
  831. 1 5 1 0 0 0 0
  832. 5 6 1 0 0 0 0
  833. 5 7 1 0 0 0 0
  834. 5 8 1 0 0 0 0
  835. M END
  836. $$$$
  837. dan050.sdf
  838. MOE2004 3D
  839. 8 7 0 0 0 0 0 0 0 0999 V2000
  840. -0.6680 -0.3780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  841. -0.4690 -1.4530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  842. -1.2710 -0.1360 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  843. -1.2710 -0.1350 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  844. 0.6160 0.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  845. 0.6950 1.0550 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0
  846. 0.6950 1.0550 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0
  847. 1.6730 -0.4320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  848. 1 2 1 0 0 0 0
  849. 1 3 1 0 0 0 0
  850. 1 4 1 0 0 0 0
  851. 1 5 1 0 0 0 0
  852. 5 6 1 0 0 0 0
  853. 5 7 1 0 0 0 0
  854. 5 8 1 0 0 0 0
  855. M END
  856. $$$$
  857. dan051.sdf
  858. MOE2004 3D
  859. 8 7 0 0 0 0 0 0 0 0999 V2000
  860. -0.6500 0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  861. -0.2750 1.5120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  862. -1.2940 0.3650 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0
  863. -1.2930 0.3650 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0
  864. 0.4370 -0.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  865. 0.3390 -1.2220 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  866. 0.3390 -1.2220 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  867. 2.3980 0.2980 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0
  868. 1 2 1 0 0 0 0
  869. 1 3 1 0 0 0 0
  870. 1 4 1 0 0 0 0
  871. 1 5 1 0 0 0 0
  872. 5 6 1 0 0 0 0
  873. 5 7 1 0 0 0 0
  874. 5 8 1 0 0 0 0
  875. M END
  876. $$$$
  877. dan052.sdf
  878. MOE2004 3D
  879. 9 8 0 0 0 0 0 0 0 0999 V2000
  880. -1.2000 -0.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  881. -1.0300 1.0450 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  882. -1.7830 -0.3050 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
  883. -1.7810 -0.3000 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
  884. 0.0000 -0.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  885. 1.2000 -0.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  886. 1.0300 1.0450 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
  887. 1.7840 -0.3060 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  888. 1.7800 -0.2990 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
  889. 1 2 1 0 0 0 0
  890. 1 3 1 0 0 0 0
  891. 1 4 1 0 0 0 0
  892. 1 5 1 0 0 0 0
  893. 5 6 1 0 0 0 0
  894. 6 7 1 0 0 0 0
  895. 6 8 1 0 0 0 0
  896. 6 9 1 0 0 0 0
  897. M END
  898. $$$$
  899. dan053.sdf
  900. MOE2004 3D
  901. 9 8 0 0 0 0 0 0 0 0999 V2000
  902. -0.8590 -0.2770 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  903. -0.8900 -0.9370 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0
  904. -0.9040 -0.9190 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0
  905. -1.7420 0.3680 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  906. 0.4130 0.5480 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  907. 0.4610 1.1770 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0
  908. 0.4620 1.1950 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0
  909. 1.5480 -0.3090 -0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0
  910. 1.5100 -0.8450 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0
  911. 1 2 1 0 0 0 0
  912. 1 3 1 0 0 0 0
  913. 1 4 1 0 0 0 0
  914. 1 5 1 0 0 0 0
  915. 5 6 1 0 0 0 0
  916. 5 7 1 0 0 0 0
  917. 5 8 1 0 0 0 0
  918. 8 9 1 0 0 0 0
  919. M END
  920. $$$$
  921. dan054.sdf
  922. MOE2004 3D
  923. 10 9 0 0 0 0 0 0 0 0999 V2000
  924. -1.7620 -0.2730 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0
  925. -2.4560 0.4100 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0
  926. -0.5110 0.4020 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0
  927. -0.4570 1.0370 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0
  928. -0.4440 1.0540 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0
  929. 0.6250 -0.6130 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0
  930. 0.5730 -1.2410 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0
  931. 0.5560 -1.2840 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0
  932. 1.8880 0.0430 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0
  933. 1.9880 0.4640 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0
  934. 1 2 1 0 0 0 0
  935. 1 3 1 0 0 0 0
  936. 3 4 1 0 0 0 0
  937. 3 5 1 0 0 0 0
  938. 3 6 1 0 0 0 0
  939. 6 7 1 0 0 0 0
  940. 6 8 1 0 0 0 0
  941. 6 9 1 0 0 0 0
  942. 9 10 1 0 0 0 0
  943. M END
  944. $$$$
  945. dan055.sdf
  946. MOE2004 3D
  947. 9 8 0 0 0 0 0 0 0 0999 V2000
  948. -1.3960 -0.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  949. -1.0820 1.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  950. -2.0110 -0.2030 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  951. -2.0100 -0.2030 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  952. 0.0000 -1.1840 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
  953. 1.3960 -0.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  954. 1.0820 1.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  955. 2.0100 -0.2030 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  956. 2.0110 -0.2030 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  957. 1 2 1 0 0 0 0
  958. 1 3 1 0 0 0 0
  959. 1 4 1 0 0 0 0
  960. 1 5 1 0 0 0 0
  961. 5 6 1 0 0 0 0
  962. 6 7 1 0 0 0 0
  963. 6 8 1 0 0 0 0
  964. 6 9 1 0 0 0 0
  965. M END
  966. $$$$
  967. dan056.sdf
  968. MOE2004 3D
  969. 9 8 0 0 0 0 0 0 0 0999 V2000
  970. -0.8660 0.3400 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  971. -0.8560 0.9770 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0
  972. -1.8140 -0.2060 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0
  973. -0.8510 0.9820 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0
  974. 0.2950 -0.6390 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  975. 0.2490 -1.2780 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0
  976. 0.2490 -1.2820 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0
  977. 1.8800 0.2440 0.1310 S 0 0 0 0 0 0 0 0 0 0 0 0
  978. 1.7140 0.8640 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0
  979. 1 2 1 0 0 0 0
  980. 1 3 1 0 0 0 0
  981. 1 4 1 0 0 0 0
  982. 1 5 1 0 0 0 0
  983. 5 6 1 0 0 0 0
  984. 5 7 1 0 0 0 0
  985. 5 8 1 0 0 0 0
  986. 8 9 1 0 0 0 0
  987. M END
  988. $$$$
  989. dan057.sdf
  990. MOE2004 3D
  991. 10 9 0 0 0 0 0 0 0 0999 V2000
  992. -1.8170 0.1010 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0
  993. -1.9810 -0.1340 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0
  994. -2.7910 0.1900 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  995. -1.3000 1.0600 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
  996. -0.8730 -1.2170 0.5450 S 0 0 0 0 0 0 0 0 0 0 0 0
  997. 0.8740 -1.2170 -0.5450 S 0 0 0 0 0 0 0 0 0 0 0 0
  998. 1.8170 0.1010 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0
  999. 1.9820 -0.1340 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0
  1000. 2.7910 0.1910 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  1001. 1.2990 1.0590 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
  1002. 1 2 1 0 0 0 0
  1003. 1 3 1 0 0 0 0
  1004. 1 4 1 0 0 0 0
  1005. 1 5 1 0 0 0 0
  1006. 5 6 1 0 0 0 0
  1007. 6 7 1 0 0 0 0
  1008. 7 8 1 0 0 0 0
  1009. 7 9 1 0 0 0 0
  1010. 7 10 1 0 0 0 0
  1011. M END
  1012. $$$$
  1013. dan058.sdf
  1014. MOE2004 3D
  1015. 10 9 0 0 0 0 0 0 0 0999 V2000
  1016. -1.7490 0.8250 -0.1380 S 0 0 0 0 0 0 0 0 0 0 0 0
  1017. -1.0630 1.7810 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0
  1018. -0.6770 -0.5650 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0
  1019. -1.2090 -1.4860 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0
  1020. -0.5570 -0.5540 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
  1021. 0.6800 -0.5650 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0
  1022. 1.2120 -1.4870 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0
  1023. 0.5600 -0.5560 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
  1024. 1.7490 0.8260 0.1360 S 0 0 0 0 0 0 0 0 0 0 0 0
  1025. 1.0550 1.7810 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1026. 1 2 1 0 0 0 0
  1027. 1 3 1 0 0 0 0
  1028. 3 4 1 0 0 0 0
  1029. 3 5 1 0 0 0 0
  1030. 3 6 1 0 0 0 0
  1031. 6 7 1 0 0 0 0
  1032. 6 8 1 0 0 0 0
  1033. 6 9 1 0 0 0 0
  1034. 9 10 1 0 0 0 0
  1035. M END
  1036. $$$$
  1037. dan059.sdf
  1038. MOE2004 3D
  1039. 9 8 0 0 0 0 0 0 0 0999 V2000
  1040. -0.3880 1.0790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1041. -0.1900 1.6860 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  1042. -0.1880 1.6880 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
  1043. -1.4550 0.8320 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  1044. 0.4640 -0.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1045. -0.0050 -1.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1046. 0.6620 -2.2590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1047. -1.0710 -1.6050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1048. 2.1700 0.1330 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1049. 1 2 1 0 0 0 0
  1050. 1 3 1 0 0 0 0
  1051. 1 4 1 0 0 0 0
  1052. 1 5 1 0 0 0 0
  1053. 5 6 2 0 0 0 0
  1054. 5 9 1 0 0 0 0
  1055. 6 7 1 0 0 0 0
  1056. 6 8 1 0 0 0 0
  1057. M END
  1058. $$$$
  1059. dan060.sdf
  1060. MOE2004 3D
  1061. 11 10 0 0 0 0 0 0 0 0999 V2000
  1062. -1.2550 0.2790 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
  1063. -1.3600 0.1200 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
  1064. -1.2180 1.3580 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  1065. 0.0000 -0.4030 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
  1066. 0.0000 -0.3430 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0
  1067. 1.2550 0.2790 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
  1068. 1.2180 1.3580 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0
  1069. 1.3600 0.1200 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
  1070. -2.7450 -0.3090 -0.5950 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1071. 0.0000 -2.1500 0.0650 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1072. 2.7450 -0.3090 -0.5950 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1073. 1 2 1 0 0 0 0
  1074. 1 3 1 0 0 0 0
  1075. 1 4 1 0 0 0 0
  1076. 1 9 1 0 0 0 0
  1077. 4 5 1 0 0 0 0
  1078. 4 6 1 0 0 0 0
  1079. 4 10 1 0 0 0 0
  1080. 6 7 1 0 0 0 0
  1081. 6 8 1 0 0 0 0
  1082. 6 11 1 0 0 0 0
  1083. M END
  1084. $$$$
  1085. dan061.sdf
  1086. MOE2004 3D
  1087. 11 10 0 0 1 0 0 0 0 0999 V2000
  1088. 1.0440 -0.4800 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0
  1089. 1.3950 0.4000 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0
  1090. 1.2070 -1.3530 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0
  1091. -0.4420 -0.3280 0.2640 C 0 0 3 0 0 0 0 0 0 0 0 0
  1092. -0.7440 0.8750 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0
  1093. -0.3090 0.7730 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0
  1094. -1.8240 1.0040 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0
  1095. -0.3520 1.7940 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0
  1096. 2.1060 -0.6580 -0.8130 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1097. -1.0840 -1.8170 -0.4960 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1098. -0.9970 -0.2100 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1099. 1 2 1 0 0 0 0
  1100. 1 3 1 0 0 0 0
  1101. 1 4 1 0 0 0 0
  1102. 1 9 1 0 0 0 0
  1103. 4 5 1 0 0 0 0
  1104. 4 10 1 0 0 0 0
  1105. 4 11 1 0 0 0 0
  1106. 5 6 1 0 0 0 0
  1107. 5 7 1 0 0 0 0
  1108. 5 8 1 0 0 0 0
  1109. M END
  1110. $$$$
  1111. dan062.sdf
  1112. MOE2004 3D
  1113. 10 9 0 0 0 0 0 0 0 0999 V2000
  1114. -1.2800 0.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1115. -2.1360 -0.5140 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1116. -1.3270 0.7920 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  1117. -1.3270 0.7920 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  1118. 0.0000 -0.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1119. 1.2810 0.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1120. 2.1360 -0.5150 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  1121. 1.3270 0.7930 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  1122. 1.3280 0.7900 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  1123. -0.0010 -1.8490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  1124. 1 2 1 0 0 0 0
  1125. 1 3 1 0 0 0 0
  1126. 1 4 1 0 0 0 0
  1127. 1 5 1 0 0 0 0
  1128. 5 6 1 0 0 0 0
  1129. 5 10 2 0 0 0 0
  1130. 6 7 1 0 0 0 0
  1131. 6 8 1 0 0 0 0
  1132. 6 9 1 0 0 0 0
  1133. M END
  1134. $$$$
  1135. dan063.sdf
  1136. MOE2004 3D
  1137. 10 9 0 0 0 0 0 0 0 0999 V2000
  1138. -1.0880 0.3380 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0
  1139. -0.9090 1.1070 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
  1140. -1.9930 -0.2120 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0
  1141. -1.2740 0.8480 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0
  1142. 0.0950 -0.6050 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0
  1143. -0.0870 -1.3590 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1144. 0.2610 -1.1190 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0
  1145. 1.3380 0.1560 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0
  1146. 1.2720 0.7640 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0
  1147. 2.3860 0.0830 -0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0
  1148. 1 2 1 0 0 0 0
  1149. 1 3 1 0 0 0 0
  1150. 1 4 1 0 0 0 0
  1151. 1 5 1 0 0 0 0
  1152. 5 6 1 0 0 0 0
  1153. 5 7 1 0 0 0 0
  1154. 5 8 1 0 0 0 0
  1155. 8 9 1 0 0 0 0
  1156. 8 10 2 0 0 0 0
  1157. M END
  1158. $$$$
  1159. dan064.sdf
  1160. MOE2004 3D
  1161. 10 10 0 0 1 0 0 0 0 0999 V2000
  1162. 1.2080 0.2030 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0
  1163. 1.0850 0.2480 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0
  1164. 1.7890 1.0750 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0
  1165. 1.7850 -0.6950 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0
  1166. -0.0990 0.1760 0.5120 C 0 0 3 0 0 0 0 0 0 0 0 0
  1167. -1.3250 -0.4250 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0
  1168. -1.2310 -0.9120 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0
  1169. -2.0920 -0.8350 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0
  1170. -1.1130 0.9940 -0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0
  1171. -0.0080 0.1710 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0
  1172. 1 2 1 0 0 0 0
  1173. 1 3 1 0 0 0 0
  1174. 1 4 1 0 0 0 0
  1175. 1 5 1 0 0 0 0
  1176. 5 6 1 0 0 0 0
  1177. 5 9 1 0 0 0 0
  1178. 5 10 1 0 0 0 0
  1179. 6 7 1 0 0 0 0
  1180. 6 8 1 0 0 0 0
  1181. 6 9 1 0 0 0 0
  1182. M END
  1183. $$$$
  1184. dan065.sdf
  1185. MOE2004 3D
  1186. 11 10 0 0 0 0 0 0 0 0999 V2000
  1187. -1.2250 -0.5460 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0
  1188. -1.3040 -0.6540 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0
  1189. -2.2320 -0.4960 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0
  1190. -0.7320 -1.4490 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1191. -0.4270 0.6950 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0
  1192. -0.3350 0.8090 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
  1193. -0.9370 1.5850 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  1194. 0.8660 0.6480 0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0
  1195. 1.8440 -0.0160 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
  1196. 1.4870 -0.4520 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0
  1197. 2.9950 -0.1240 0.2580 O 0 0 0 0 0 0 0 0 0 0 0 0
  1198. 1 2 1 0 0 0 0
  1199. 1 3 1 0 0 0 0
  1200. 1 4 1 0 0 0 0
  1201. 1 5 1 0 0 0 0
  1202. 5 6 1 0 0 0 0
  1203. 5 7 1 0 0 0 0
  1204. 5 8 1 0 0 0 0
  1205. 8 9 1 0 0 0 0
  1206. 9 10 1 0 0 0 0
  1207. 9 11 2 0 0 0 0
  1208. M END
  1209. $$$$
  1210. dan066.sdf
  1211. MOE2004 3D
  1212. 11 10 0 0 0 0 0 0 0 0999 V2000
  1213. -0.9730 -0.8880 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  1214. -0.4870 -1.2660 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
  1215. -0.4870 -1.2650 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0
  1216. -2.0040 -1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1217. -0.9940 0.6190 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  1218. -2.0430 1.2520 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  1219. 0.2170 1.2530 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0
  1220. 1.4450 0.5150 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  1221. 1.5310 -0.0970 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
  1222. 1.5250 -0.0980 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0
  1223. 2.2690 1.2330 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  1224. 1 2 1 0 0 0 0
  1225. 1 3 1 0 0 0 0
  1226. 1 4 1 0 0 0 0
  1227. 1 5 1 0 0 0 0
  1228. 5 6 2 0 0 0 0
  1229. 5 7 1 0 0 0 0
  1230. 7 8 1 0 0 0 0
  1231. 8 9 1 0 0 0 0
  1232. 8 10 1 0 0 0 0
  1233. 8 11 1 0 0 0 0
  1234. M END
  1235. $$$$
  1236. dan067.sdf
  1237. MOE2004 3D
  1238. 11 10 0 0 0 0 0 0 0 0999 V2000
  1239. 1.1490 -0.1030 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0
  1240. 1.0080 -0.7860 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0
  1241. 1.0910 0.9190 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0
  1242. 2.1540 -0.2580 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0
  1243. 0.1040 -0.3440 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0
  1244. 0.1950 -1.3620 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0
  1245. 0.2410 0.3340 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0
  1246. -1.2900 -0.1780 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
  1247. -2.0200 -1.1070 -0.2790 O 0 0 0 0 0 0 0 0 0 0 0 0
  1248. -1.6570 1.1210 -0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0
  1249. -0.9750 1.7640 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0
  1250. 1 2 1 0 0 0 0
  1251. 1 3 1 0 0 0 0
  1252. 1 4 1 0 0 0 0
  1253. 1 5 1 0 0 0 0
  1254. 5 6 1 0 0 0 0
  1255. 5 7 1 0 0 0 0
  1256. 5 8 1 0 0 0 0
  1257. 8 9 2 0 0 0 0
  1258. 8 10 1 0 0 0 0
  1259. 10 11 1 0 0 0 0
  1260. M END
  1261. $$$$
  1262. dan068.sdf
  1263. MOE2004 3D
  1264. 11 10 0 0 0 0 0 0 0 0999 V2000
  1265. 1.0650 -0.6480 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0
  1266. 0.9490 -0.6460 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0
  1267. 1.4930 -1.6050 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0
  1268. -0.2460 -0.3840 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0
  1269. -0.8750 -1.2760 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  1270. -0.0760 -0.2270 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0
  1271. -1.0210 0.7970 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0
  1272. -1.9850 0.8950 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0
  1273. -1.2190 0.6600 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
  1274. -0.4810 1.7390 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
  1275. 2.3980 0.6930 -0.1690 Br 0 0 0 0 0 0 0 0 0 0 0 0
  1276. 1 2 1 0 0 0 0
  1277. 1 3 1 0 0 0 0
  1278. 1 4 1 0 0 0 0
  1279. 1 11 1 0 0 0 0
  1280. 4 5 1 0 0 0 0
  1281. 4 6 1 0 0 0 0
  1282. 4 7 1 0 0 0 0
  1283. 7 8 1 0 0 0 0
  1284. 7 9 1 0 0 0 0
  1285. 7 10 1 0 0 0 0
  1286. M END
  1287. $$$$
  1288. dan069.sdf
  1289. MOE2004 3D
  1290. 11 10 0 0 0 0 0 0 0 0999 V2000
  1291. 0.2430 1.2600 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0
  1292. 0.2180 1.3100 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0
  1293. -0.2430 2.1600 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0
  1294. 1.2920 1.2890 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
  1295. -0.4380 0.0000 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0
  1296. -0.4190 0.0010 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0
  1297. 0.2410 -1.2600 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0
  1298. 1.2900 -1.2910 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
  1299. -0.2460 -2.1600 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0
  1300. 0.2160 -1.3110 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0
  1301. -2.1560 0.0010 -0.0970 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1302. 1 2 1 0 0 0 0
  1303. 1 3 1 0 0 0 0
  1304. 1 4 1 0 0 0 0
  1305. 1 5 1 0 0 0 0
  1306. 5 6 1 0 0 0 0
  1307. 5 7 1 0 0 0 0
  1308. 5 11 1 0 0 0 0
  1309. 7 8 1 0 0 0 0
  1310. 7 9 1 0 0 0 0
  1311. 7 10 1 0 0 0 0
  1312. M END
  1313. $$$$
  1314. dan070.sdf
  1315. MOE2004 3D
  1316. 11 10 0 0 0 0 0 0 0 0999 V2000
  1317. -1.0220 0.7930 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
  1318. -1.1400 0.7590 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
  1319. -2.0200 0.8180 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0
  1320. -0.5190 1.7280 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0
  1321. -0.2540 -0.4210 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0
  1322. -0.1460 -0.3580 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0
  1323. -0.8500 -1.3170 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1324. 1.1140 -0.5900 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0
  1325. 1.5760 -1.5260 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0
  1326. 1.0290 -0.6160 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0
  1327. 2.2310 0.7290 0.1810 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1328. 1 2 1 0 0 0 0
  1329. 1 3 1 0 0 0 0
  1330. 1 4 1 0 0 0 0
  1331. 1 5 1 0 0 0 0
  1332. 5 6 1 0 0 0 0
  1333. 5 7 1 0 0 0 0
  1334. 5 8 1 0 0 0 0
  1335. 8 9 1 0 0 0 0
  1336. 8 10 1 0 0 0 0
  1337. 8 11 1 0 0 0 0
  1338. M END
  1339. $$$$
  1340. dan071.sdf
  1341. MOE2004 3D
  1342. 11 10 0 0 0 0 0 0 0 0999 V2000
  1343. -0.2680 1.2660 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  1344. 0.2010 2.1660 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
  1345. -1.3340 1.3070 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0
  1346. -0.1760 1.3110 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  1347. 0.3640 0.0000 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0
  1348. 0.2870 0.0000 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0
  1349. -0.2690 -1.2660 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  1350. -1.3350 -1.3060 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0
  1351. 0.2000 -2.1660 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
  1352. -0.1770 -1.3110 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  1353. 2.5060 0.0000 0.0660 I 0 0 0 0 0 0 0 0 0 0 0 0
  1354. 1 2 1 0 0 0 0
  1355. 1 3 1 0 0 0 0
  1356. 1 4 1 0 0 0 0
  1357. 1 5 1 0 0 0 0
  1358. 5 6 1 0 0 0 0
  1359. 5 7 1 0 0 0 0
  1360. 5 11 1 0 0 0 0
  1361. 7 8 1 0 0 0 0
  1362. 7 9 1 0 0 0 0
  1363. 7 10 1 0 0 0 0
  1364. M END
  1365. $$$$
  1366. dan072.sdf
  1367. MOE2004 3D
  1368. 11 10 0 0 0 0 0 0 0 0999 V2000
  1369. -0.9960 0.8380 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0
  1370. -1.2260 0.6650 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0
  1371. -1.9420 1.0020 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0
  1372. -0.4130 1.7600 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0
  1373. -0.2620 -0.3520 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
  1374. -0.0590 -0.1610 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0
  1375. -0.9390 -1.2130 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0
  1376. 1.0180 -0.7230 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
  1377. 1.3510 -1.7170 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  1378. 0.8490 -0.7590 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  1379. 2.6210 0.6600 0.1520 I 0 0 0 0 0 0 0 0 0 0 0 0
  1380. 1 2 1 0 0 0 0
  1381. 1 3 1 0 0 0 0
  1382. 1 4 1 0 0 0 0
  1383. 1 5 1 0 0 0 0
  1384. 5 6 1 0 0 0 0
  1385. 5 7 1 0 0 0 0
  1386. 5 8 1 0 0 0 0
  1387. 8 9 1 0 0 0 0
  1388. 8 10 1 0 0 0 0
  1389. 8 11 1 0 0 0 0
  1390. M END
  1391. $$$$
  1392. dan073.sdf
  1393. MOE2004 3D
  1394. 12 11 0 0 0 0 0 0 0 0999 V2000
  1395. -1.2610 0.3750 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0
  1396. -1.3080 0.4020 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0
  1397. -2.1520 -0.1640 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
  1398. -1.3110 1.4010 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0
  1399. 0.0000 -0.3310 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0
  1400. 0.0000 -0.3780 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0
  1401. 1.2620 0.3740 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0
  1402. 1.3140 1.3990 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0
  1403. 2.1520 -0.1680 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0
  1404. 1.3080 0.4020 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0
  1405. -0.0010 -1.6720 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0
  1406. -0.0030 -1.6400 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  1407. 1 2 1 0 0 0 0
  1408. 1 3 1 0 0 0 0
  1409. 1 4 1 0 0 0 0
  1410. 1 5 1 0 0 0 0
  1411. 5 6 1 0 0 0 0
  1412. 5 7 1 0 0 0 0
  1413. 5 11 1 0 0 0 0
  1414. 7 8 1 0 0 0 0
  1415. 7 9 1 0 0 0 0
  1416. 7 10 1 0 0 0 0
  1417. 11 12 1 0 0 0 0
  1418. M END
  1419. $$$$
  1420. dan074.sdf
  1421. MOE2004 3D
  1422. 12 11 0 0 0 0 0 0 0 0999 V2000
  1423. -1.7760 -0.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1424. -1.8780 -0.9780 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  1425. -1.8790 -0.9760 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  1426. -2.5910 0.3960 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1427. -0.4280 0.3600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1428. -0.3320 0.9890 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  1429. -0.3320 0.9880 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0
  1430. 0.5950 -0.6380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  1431. 1.8970 -0.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1432. 2.0440 0.5540 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0
  1433. 2.6360 -0.8610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1434. 2.0440 0.5540 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0
  1435. 1 2 1 0 0 0 0
  1436. 1 3 1 0 0 0 0
  1437. 1 4 1 0 0 0 0
  1438. 1 5 1 0 0 0 0
  1439. 5 6 1 0 0 0 0
  1440. 5 7 1 0 0 0 0
  1441. 5 8 1 0 0 0 0
  1442. 8 9 1 0 0 0 0
  1443. 9 10 1 0 0 0 0
  1444. 9 11 1 0 0 0 0
  1445. 9 12 1 0 0 0 0
  1446. M END
  1447. $$$$
  1448. dan075.sdf
  1449. MOE2004 3D
  1450. 12 11 0 0 0 0 0 0 0 0999 V2000
  1451. -1.5140 0.1340 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0
  1452. -1.6480 0.7640 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0
  1453. -2.3050 -0.6220 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0
  1454. -1.6420 0.7600 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0
  1455. -0.1480 -0.5310 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0
  1456. -0.0490 -1.1880 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0
  1457. -0.0570 -1.1810 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0
  1458. 0.9800 0.4930 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0
  1459. 0.9340 1.1390 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0
  1460. 0.9310 1.1280 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
  1461. 2.2360 -0.1740 0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0
  1462. 2.2820 -0.7210 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0
  1463. 1 2 1 0 0 0 0
  1464. 1 3 1 0 0 0 0
  1465. 1 4 1 0 0 0 0
  1466. 1 5 1 0 0 0 0
  1467. 5 6 1 0 0 0 0
  1468. 5 7 1 0 0 0 0
  1469. 5 8 1 0 0 0 0
  1470. 8 9 1 0 0 0 0
  1471. 8 10 1 0 0 0 0
  1472. 8 11 1 0 0 0 0
  1473. 11 12 1 0 0 0 0
  1474. M END
  1475. $$$$
  1476. dan076.sdf
  1477. MOE2004 3D
  1478. 13 12 0 0 1 0 0 0 0 0999 V2000
  1479. -1.4150 -0.4820 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0
  1480. -2.2600 0.0730 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  1481. -1.4640 -1.5140 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0
  1482. -1.5480 -0.4820 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0
  1483. -0.1000 0.1770 -0.3480 C 0 0 3 0 0 0 0 0 0 0 0 0
  1484. -0.0620 1.5190 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0
  1485. -0.8420 1.9830 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
  1486. 1.1040 -0.5620 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
  1487. 1.0520 -0.6030 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0
  1488. 1.1800 -1.5810 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0
  1489. 2.2910 0.1490 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0
  1490. 2.0700 1.0880 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0
  1491. -0.0060 0.2350 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0
  1492. 1 2 1 0 0 0 0
  1493. 1 3 1 0 0 0 0
  1494. 1 4 1 0 0 0 0
  1495. 1 5 1 0 0 0 0
  1496. 5 6 1 0 0 0 0
  1497. 5 8 1 0 0 0 0
  1498. 5 13 1 0 0 0 0
  1499. 6 7 1 0 0 0 0
  1500. 8 9 1 0 0 0 0
  1501. 8 10 1 0 0 0 0
  1502. 8 11 1 0 0 0 0
  1503. 11 12 1 0 0 0 0
  1504. M END
  1505. $$$$
  1506. dan077.sdf
  1507. MOE2004 3D
  1508. 13 12 0 0 0 0 0 0 0 0999 V2000
  1509. -1.2590 0.4420 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0
  1510. -1.2950 1.0680 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0
  1511. -1.3100 1.0980 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0
  1512. 0.0000 -0.4110 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0
  1513. -0.0010 -1.0680 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0
  1514. 0.0020 -1.0950 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0
  1515. 1.2600 0.4420 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0
  1516. 1.3120 1.0910 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0
  1517. 1.2960 1.0740 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
  1518. -2.4100 -0.3940 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0
  1519. -2.3970 -0.9200 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0
  1520. 2.4110 -0.3940 0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0
  1521. 2.3920 -0.9350 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0
  1522. 1 2 1 0 0 0 0
  1523. 1 3 1 0 0 0 0
  1524. 1 4 1 0 0 0 0
  1525. 1 10 1 0 0 0 0
  1526. 4 5 1 0 0 0 0
  1527. 4 6 1 0 0 0 0
  1528. 4 7 1 0 0 0 0
  1529. 7 8 1 0 0 0 0
  1530. 7 9 1 0 0 0 0
  1531. 7 12 1 0 0 0 0
  1532. 10 11 1 0 0 0 0
  1533. 12 13 1 0 0 0 0
  1534. M END
  1535. $$$$
  1536. dan078.sdf
  1537. MOE2004 3D
  1538. 12 11 0 0 0 0 0 0 0 0999 V2000
  1539. 0.4090 1.2600 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
  1540. 0.3920 1.3110 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0
  1541. -0.0670 2.1650 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0
  1542. 1.4580 1.2840 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0
  1543. -0.2740 0.0000 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0
  1544. -0.2370 0.0000 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0
  1545. 0.4060 -1.2610 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
  1546. 1.4550 -1.2870 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0
  1547. -0.0730 -2.1650 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0
  1548. 0.3910 -1.3110 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0
  1549. -2.0320 0.0020 0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0
  1550. -1.8270 0.0010 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  1551. 1 2 1 0 0 0 0
  1552. 1 3 1 0 0 0 0
  1553. 1 4 1 0 0 0 0
  1554. 1 5 1 0 0 0 0
  1555. 5 6 1 0 0 0 0
  1556. 5 7 1 0 0 0 0
  1557. 5 11 1 0 0 0 0
  1558. 7 8 1 0 0 0 0
  1559. 7 9 1 0 0 0 0
  1560. 7 10 1 0 0 0 0
  1561. 11 12 1 0 0 0 0
  1562. M END
  1563. $$$$
  1564. dan079.sdf
  1565. MOE2004 3D
  1566. 12 11 0 0 0 0 0 0 0 0999 V2000
  1567. -1.5560 0.0980 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1568. -1.7110 0.7170 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0
  1569. -1.7130 0.7230 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0
  1570. -2.3180 -0.6880 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0
  1571. -0.1650 -0.5150 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0
  1572. -0.0610 -1.1590 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0
  1573. -0.0650 -1.1540 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0
  1574. 0.9140 0.5650 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0
  1575. 0.8230 1.2030 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0
  1576. 0.8220 1.2020 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0
  1577. 2.5700 -0.1800 0.1000 S 0 0 0 0 0 0 0 0 0 0 0 0
  1578. 2.4600 -0.8110 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0
  1579. 1 2 1 0 0 0 0
  1580. 1 3 1 0 0 0 0
  1581. 1 4 1 0 0 0 0
  1582. 1 5 1 0 0 0 0
  1583. 5 6 1 0 0 0 0
  1584. 5 7 1 0 0 0 0
  1585. 5 8 1 0 0 0 0
  1586. 8 9 1 0 0 0 0
  1587. 8 10 1 0 0 0 0
  1588. 8 11 1 0 0 0 0
  1589. 11 12 1 0 0 0 0
  1590. M END
  1591. $$$$
  1592. dan080.sdf
  1593. MOE2004 2D
  1594. 9 9 0 0 0 0 0 0 0 0999 V2000
  1595. 0.5810 -1.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1596. 1.0890 -2.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1597. -0.7430 -0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1598. -1.5950 -1.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1599. -0.7500 0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1600. -1.6090 1.3600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1601. 0.5700 1.0940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1602. 1.0690 2.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1603. 1.3880 0.0070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  1604. 1 2 1 0 0 0 0
  1605. 1 3 2 0 0 0 0
  1606. 1 9 1 0 0 0 0
  1607. 3 4 1 0 0 0 0
  1608. 3 5 1 0 0 0 0
  1609. 5 6 1 0 0 0 0
  1610. 5 7 2 0 0 0 0
  1611. 7 8 1 0 0 0 0
  1612. 7 9 1 0 0 0 0
  1613. M END
  1614. $$$$
  1615. dan081.sdf
  1616. MOE2004 2D
  1617. 9 9 0 0 0 0 0 0 0 0999 V2000
  1618. 0.5660 -1.2300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1619. 0.8580 -2.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1620. -0.7100 -0.7100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1621. -1.6010 -1.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1622. -0.7090 0.7110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1623. -1.5980 1.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1624. 0.5680 1.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1625. 0.8620 2.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1626. 1.7620 -0.0010 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
  1627. 1 2 1 0 0 0 0
  1628. 1 3 2 0 0 0 0
  1629. 1 9 1 0 0 0 0
  1630. 3 4 1 0 0 0 0
  1631. 3 5 1 0 0 0 0
  1632. 5 6 1 0 0 0 0
  1633. 5 7 2 0 0 0 0
  1634. 7 8 1 0 0 0 0
  1635. 7 9 1 0 0 0 0
  1636. M END
  1637. $$$$
  1638. dan082.sdf
  1639. MOE2004 3D
  1640. 11 11 0 0 0 0 0 0 0 0999 V2000
  1641. 0.5120 -1.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1642. 0.7290 -1.7610 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0
  1643. 0.7290 -1.7610 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0
  1644. -0.8790 -0.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1645. -1.7590 -1.2940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  1646. -0.8800 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1647. -1.7610 1.2910 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1648. 0.5100 1.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1649. 0.7250 1.7620 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0
  1650. 0.7250 1.7630 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0
  1651. 1.3500 0.0010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  1652. 1 2 1 0 0 0 0
  1653. 1 3 1 0 0 0 0
  1654. 1 4 1 0 0 0 0
  1655. 1 11 1 0 0 0 0
  1656. 4 5 1 0 0 0 0
  1657. 4 6 2 0 0 0 0
  1658. 6 7 1 0 0 0 0
  1659. 6 8 1 0 0 0 0
  1660. 8 9 1 0 0 0 0
  1661. 8 10 1 0 0 0 0
  1662. 8 11 1 0 0 0 0
  1663. M END
  1664. $$$$
  1665. dan083.sdf
  1666. MOE2004 3D
  1667. 12 11 0 0 0 0 0 0 0 0999 V2000
  1668. -0.9210 0.9200 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  1669. -0.7190 1.5270 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0
  1670. -1.9900 0.6820 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  1671. -0.7320 1.5260 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0
  1672. -0.0720 -0.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1673. -0.6150 -1.5370 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
  1674. -0.0090 -2.4390 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0
  1675. -1.6910 -1.6820 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  1676. 1.4100 -0.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1677. 2.1360 -1.2220 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0
  1678. 1.9170 1.0150 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0
  1679. 1.2850 1.7560 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  1680. 1 2 1 0 0 0 0
  1681. 1 3 1 0 0 0 0
  1682. 1 4 1 0 0 0 0
  1683. 1 5 1 0 0 0 0
  1684. 5 6 2 0 0 0 0
  1685. 5 9 1 0 0 0 0
  1686. 6 7 1 0 0 0 0
  1687. 6 8 1 0 0 0 0
  1688. 9 10 2 0 0 0 0
  1689. 9 11 1 0 0 0 0
  1690. 11 12 1 0 0 0 0
  1691. M END
  1692. $$$$
  1693. dan084.sdf
  1694. MOE2004 3D
  1695. 14 13 0 0 1 0 0 0 0 0999 V2000
  1696. 0.1320 1.6430 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0
  1697. -0.2640 2.6480 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
  1698. 0.1550 1.4810 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0
  1699. -0.7150 0.5790 -0.3780 C 0 0 3 0 0 0 0 0 0 0 0 0
  1700. -0.5300 -0.8610 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0
  1701. -1.2700 -1.5080 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0
  1702. -0.7410 -0.9100 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0
  1703. 0.8390 -1.4690 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0
  1704. 0.8180 -2.5410 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0
  1705. 1.1410 -1.3470 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0
  1706. 1.6020 -1.0280 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0
  1707. 1.8170 1.6850 -0.2490 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1708. -2.4460 1.0120 -0.1540 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1709. -0.5400 0.6150 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0
  1710. 1 2 1 0 0 0 0
  1711. 1 3 1 0 0 0 0
  1712. 1 4 1 0 0 0 0
  1713. 1 12 1 0 0 0 0
  1714. 4 5 1 0 0 0 0
  1715. 4 13 1 0 0 0 0
  1716. 4 14 1 0 0 0 0
  1717. 5 6 1 0 0 0 0
  1718. 5 7 1 0 0 0 0
  1719. 5 8 1 0 0 0 0
  1720. 8 9 1 0 0 0 0
  1721. 8 10 1 0 0 0 0
  1722. 8 11 1 0 0 0 0
  1723. M END
  1724. $$$$
  1725. dan085.sdf
  1726. MOE2004 3D
  1727. 14 13 0 0 1 0 0 0 0 0999 V2000
  1728. -1.7270 -0.9350 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
  1729. -1.7000 -1.5540 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0
  1730. -2.7520 -0.5680 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  1731. -1.5100 -1.5800 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0
  1732. -0.7390 0.2280 -0.0280 C 0 0 3 0 0 0 0 0 0 0 0 0
  1733. 0.7390 -0.2280 -0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0
  1734. 1.7270 0.9350 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
  1735. 1.7020 1.5530 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0
  1736. 2.7520 0.5680 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  1737. 1.5080 1.5810 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0
  1738. -1.1450 1.2630 1.3820 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1739. 1.1450 -1.2630 1.3810 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  1740. -0.9040 0.8560 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0
  1741. 0.9040 -0.8560 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0
  1742. 1 2 1 0 0 0 0
  1743. 1 3 1 0 0 0 0
  1744. 1 4 1 0 0 0 0
  1745. 1 5 1 0 0 0 0
  1746. 5 6 1 0 0 0 0
  1747. 5 11 1 0 0 0 0
  1748. 5 13 1 0 0 0 0
  1749. 6 7 1 0 0 0 0
  1750. 6 12 1 0 0 0 0
  1751. 6 14 1 0 0 0 0
  1752. 7 8 1 0 0 0 0
  1753. 7 9 1 0 0 0 0
  1754. 7 10 1 0 0 0 0
  1755. M END
  1756. $$$$
  1757. dan086.sdf
  1758. MOE2004 3D
  1759. 13 12 0 0 0 0 0 0 0 0999 V2000
  1760. 1.7110 -0.0660 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0
  1761. 1.7260 -0.2370 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0
  1762. 0.6210 -0.7720 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0
  1763. 0.6800 -0.4970 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
  1764. 0.8150 -1.8460 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0
  1765. -0.7560 -0.4530 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0
  1766. -1.4910 -1.1350 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
  1767. -0.7670 -0.6250 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  1768. -1.1900 0.9780 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0
  1769. -2.1950 1.1540 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0
  1770. -1.2100 1.1780 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
  1771. -0.5150 1.7010 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0
  1772. 2.5710 0.6210 0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0
  1773. 1 2 1 0 0 0 0
  1774. 1 3 1 0 0 0 0
  1775. 1 13 2 0 0 0 0
  1776. 3 4 1 0 0 0 0
  1777. 3 5 1 0 0 0 0
  1778. 3 6 1 0 0 0 0
  1779. 6 7 1 0 0 0 0
  1780. 6 8 1 0 0 0 0
  1781. 6 9 1 0 0 0 0
  1782. 9 10 1 0 0 0 0
  1783. 9 11 1 0 0 0 0
  1784. 9 12 1 0 0 0 0
  1785. M END
  1786. $$$$
  1787. dan087.sdf
  1788. MOE2004 3D
  1789. 13 12 0 0 0 0 0 0 0 0999 V2000
  1790. 1.5430 -0.2240 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0
  1791. 1.4240 -0.8660 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0
  1792. 1.4380 0.8140 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0
  1793. 2.5580 -0.3560 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0
  1794. 0.5210 -0.5690 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0
  1795. 0.6830 -1.5910 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0
  1796. 0.6210 0.0940 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0
  1797. -0.8900 -0.4700 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0
  1798. -1.5190 -1.4710 -0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0
  1799. -1.4800 0.9080 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
  1800. -2.5320 0.8290 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0
  1801. -1.4230 1.4340 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0
  1802. -0.9430 1.4670 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0
  1803. 1 2 1 0 0 0 0
  1804. 1 3 1 0 0 0 0
  1805. 1 4 1 0 0 0 0
  1806. 1 5 1 0 0 0 0
  1807. 5 6 1 0 0 0 0
  1808. 5 7 1 0 0 0 0
  1809. 5 8 1 0 0 0 0
  1810. 8 9 2 0 0 0 0
  1811. 8 10 1 0 0 0 0
  1812. 10 11 1 0 0 0 0
  1813. 10 12 1 0 0 0 0
  1814. 10 13 1 0 0 0 0
  1815. M END
  1816. $$$$
  1817. dan088.sdf
  1818. MOE2004 3D
  1819. 13 12 0 0 0 0 0 0 0 0999 V2000
  1820. -0.6070 -1.2600 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  1821. -0.8070 -1.3040 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0
  1822. -1.5670 -1.3010 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0
  1823. -0.0380 -2.1580 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0
  1824. 0.1650 0.0000 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0
  1825. 0.3580 0.0000 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0
  1826. -0.6080 1.2600 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  1827. -1.5660 1.3010 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0
  1828. -0.8090 1.3030 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0
  1829. -0.0390 2.1580 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
  1830. 1.4950 0.0010 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0
  1831. 1.4510 0.0020 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0
  1832. 2.5730 0.0000 -0.2610 O 0 0 0 0 0 0 0 0 0 0 0 0
  1833. 1 2 1 0 0 0 0
  1834. 1 3 1 0 0 0 0
  1835. 1 4 1 0 0 0 0
  1836. 1 5 1 0 0 0 0
  1837. 5 6 1 0 0 0 0
  1838. 5 7 1 0 0 0 0
  1839. 5 11 1 0 0 0 0
  1840. 7 8 1 0 0 0 0
  1841. 7 9 1 0 0 0 0
  1842. 7 10 1 0 0 0 0
  1843. 11 12 1 0 0 0 0
  1844. 11 13 2 0 0 0 0
  1845. M END
  1846. $$$$
  1847. dan089.sdf
  1848. MOE2004 3D
  1849. 13 13 0 0 0 0 0 0 0 0999 V2000
  1850. -1.5100 -0.0030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  1851. -0.6940 1.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1852. -0.9400 1.7630 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  1853. -0.9410 1.7640 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  1854. 0.7590 0.7530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1855. 1.2790 1.1540 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0
  1856. 1.2780 1.1530 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0
  1857. 0.7620 -0.7510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1858. 1.2830 -1.1490 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0
  1859. 1.2820 -1.1490 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0
  1860. -0.6900 -1.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  1861. -0.9330 -1.7670 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  1862. -0.9340 -1.7670 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  1863. 1 2 1 0 0 0 0
  1864. 1 11 1 0 0 0 0
  1865. 2 3 1 0 0 0 0
  1866. 2 4 1 0 0 0 0
  1867. 2 5 1 0 0 0 0
  1868. 5 6 1 0 0 0 0
  1869. 5 7 1 0 0 0 0
  1870. 5 8 1 0 0 0 0
  1871. 8 9 1 0 0 0 0
  1872. 8 10 1 0 0 0 0
  1873. 8 11 1 0 0 0 0
  1874. 11 12 1 0 0 0 0
  1875. 11 13 1 0 0 0 0
  1876. M END
  1877. $$$$
  1878. dan090.sdf
  1879. MOE2004 3D
  1880. 14 13 0 0 0 0 0 0 0 0999 V2000
  1881. 1.3500 0.5960 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0
  1882. 1.5970 1.2260 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  1883. 2.2680 0.4330 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0
  1884. 0.6520 1.1440 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  1885. 0.7670 -0.7370 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
  1886. 0.5330 -1.3420 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0
  1887. 1.5320 -1.2800 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0
  1888. -0.4720 -0.5770 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0
  1889. -0.7440 -1.5410 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0
  1890. -0.2840 0.0960 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0
  1891. -1.6670 -0.1060 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
  1892. -2.3440 -0.8350 -0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0
  1893. -1.9070 1.2240 0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0
  1894. -1.2810 1.7000 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0
  1895. 1 2 1 0 0 0 0
  1896. 1 3 1 0 0 0 0
  1897. 1 4 1 0 0 0 0
  1898. 1 5 1 0 0 0 0
  1899. 5 6 1 0 0 0 0
  1900. 5 7 1 0 0 0 0
  1901. 5 8 1 0 0 0 0
  1902. 8 9 1 0 0 0 0
  1903. 8 10 1 0 0 0 0
  1904. 8 11 1 0 0 0 0
  1905. 11 12 2 0 0 0 0
  1906. 11 13 1 0 0 0 0
  1907. 13 14 1 0 0 0 0
  1908. M END
  1909. $$$$
  1910. dan091.sdf
  1911. MOE2004 3D
  1912. 14 13 0 0 0 0 0 0 0 0999 V2000
  1913. 1.9790 0.2870 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0
  1914. 2.0920 -0.5750 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0
  1915. 2.9730 0.6570 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0
  1916. 1.4590 1.0630 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0
  1917. 1.1950 -0.0980 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0
  1918. 1.0840 0.7540 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0
  1919. 1.7330 -0.8770 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0
  1920. -0.0810 -0.6420 -0.3500 O 0 0 0 0 0 0 0 0 0 0 0 0
  1921. -1.0880 0.2630 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0
  1922. -0.9930 1.4770 -0.2810 O 0 0 0 0 0 0 0 0 0 0 0 0
  1923. -2.3510 -0.4530 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0
  1924. -2.2010 -1.0080 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  1925. -3.1500 0.2780 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0
  1926. -2.6500 -1.1270 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0
  1927. 1 2 1 0 0 0 0
  1928. 1 3 1 0 0 0 0
  1929. 1 4 1 0 0 0 0
  1930. 1 5 1 0 0 0 0
  1931. 5 6 1 0 0 0 0
  1932. 5 7 1 0 0 0 0
  1933. 5 8 1 0 0 0 0
  1934. 8 9 1 0 0 0 0
  1935. 9 10 2 0 0 0 0
  1936. 9 11 1 0 0 0 0
  1937. 11 12 1 0 0 0 0
  1938. 11 13 1 0 0 0 0
  1939. 11 14 1 0 0 0 0
  1940. M END
  1941. $$$$
  1942. dan092.sdf
  1943. MOE2004 3D
  1944. 14 13 0 0 0 0 0 0 0 0999 V2000
  1945. -0.6090 1.0680 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0
  1946. -0.0240 1.9930 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0
  1947. -1.6460 1.3140 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0
  1948. -0.5800 0.7180 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0
  1949. -0.0530 0.0140 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0
  1950. -0.0750 0.3950 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0
  1951. -0.9020 -1.2560 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0
  1952. -0.4930 -2.0180 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0
  1953. -0.9360 -1.6870 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0
  1954. -1.9300 -1.0480 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0
  1955. 1.3940 -0.2940 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  1956. 1.7720 -1.2880 0.6410 O 0 0 0 0 0 0 0 0 0 0 0 0
  1957. 2.2530 0.6720 -0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0
  1958. 1.8300 1.4170 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0
  1959. 1 2 1 0 0 0 0
  1960. 1 3 1 0 0 0 0
  1961. 1 4 1 0 0 0 0
  1962. 1 5 1 0 0 0 0
  1963. 5 6 1 0 0 0 0
  1964. 5 7 1 0 0 0 0
  1965. 5 11 1 0 0 0 0
  1966. 7 8 1 0 0 0 0
  1967. 7 9 1 0 0 0 0
  1968. 7 10 1 0 0 0 0
  1969. 11 12 2 0 0 0 0
  1970. 11 13 1 0 0 0 0
  1971. 13 14 1 0 0 0 0
  1972. M END
  1973. $$$$
  1974. dan093.sdf
  1975. MOE2004 3D
  1976. 14 13 0 0 0 0 0 0 0 0999 V2000
  1977. -2.3880 0.2680 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0
  1978. -2.8570 -0.4970 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0
  1979. -2.9580 1.1960 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  1980. -2.4050 -0.0330 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0
  1981. -1.0470 0.5180 0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0
  1982. -0.2310 -0.5770 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0
  1983. -0.5600 -1.6970 -0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0
  1984. 1.1600 -0.2100 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0
  1985. 1.6240 -1.0990 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0
  1986. 1.1010 0.5390 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0
  1987. 1.9820 0.3000 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0
  1988. 2.0590 -0.4570 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
  1989. 1.5270 1.1920 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0
  1990. 2.9940 0.5580 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  1991. 1 2 1 0 0 0 0
  1992. 1 3 1 0 0 0 0
  1993. 1 4 1 0 0 0 0
  1994. 1 5 1 0 0 0 0
  1995. 5 6 1 0 0 0 0
  1996. 6 7 2 0 0 0 0
  1997. 6 8 1 0 0 0 0
  1998. 8 9 1 0 0 0 0
  1999. 8 10 1 0 0 0 0
  2000. 8 11 1 0 0 0 0
  2001. 11 12 1 0 0 0 0
  2002. 11 13 1 0 0 0 0
  2003. 11 14 1 0 0 0 0
  2004. M END
  2005. $$$$
  2006. dan094.sdf
  2007. MOE2004 3D
  2008. 14 13 0 0 0 0 0 0 0 0999 V2000
  2009. 2.0010 -0.2300 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0
  2010. 2.4540 0.7310 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0
  2011. 2.0290 -0.3360 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0
  2012. 2.6170 -1.0240 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0
  2013. 0.5780 -0.3240 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0
  2014. 0.5760 -0.2550 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0
  2015. 0.1620 -1.3090 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0
  2016. -0.3120 0.7710 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0
  2017. -0.3480 0.7230 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0
  2018. 0.0800 1.7580 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0
  2019. -1.6330 0.6790 -0.4510 O 0 0 0 0 0 0 0 0 0 0 0 0
  2020. -2.5010 -0.1640 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0
  2021. -2.0440 -0.6860 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0
  2022. -3.6590 -0.3330 -0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0
  2023. 1 2 1 0 0 0 0
  2024. 1 3 1 0 0 0 0
  2025. 1 4 1 0 0 0 0
  2026. 1 5 1 0 0 0 0
  2027. 5 6 1 0 0 0 0
  2028. 5 7 1 0 0 0 0
  2029. 5 8 1 0 0 0 0
  2030. 8 9 1 0 0 0 0
  2031. 8 10 1 0 0 0 0
  2032. 8 11 1 0 0 0 0
  2033. 11 12 1 0 0 0 0
  2034. 12 13 1 0 0 0 0
  2035. 12 14 2 0 0 0 0
  2036. M END
  2037. $$$$
  2038. dan095.sdf
  2039. MOE2004 3D
  2040. 13 13 0 0 0 0 0 0 0 0999 V2000
  2041. -1.7430 0.5950 0.0010 S 0 0 0 0 0 0 0 0 0 0 0 0
  2042. -1.0200 -1.0610 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0
  2043. -1.0940 -1.3870 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0
  2044. -1.5500 -1.7800 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
  2045. 0.4300 -0.8950 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0
  2046. 1.0460 -1.7160 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0
  2047. 0.5150 -0.9070 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0
  2048. 0.8880 0.4450 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0
  2049. 1.8770 0.7180 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0
  2050. 0.9640 0.4020 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0
  2051. -0.1580 1.4630 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0
  2052. -0.0170 1.7680 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0
  2053. -0.1380 2.3560 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0
  2054. 1 2 1 0 0 0 0
  2055. 1 11 1 0 0 0 0
  2056. 2 3 1 0 0 0 0
  2057. 2 4 1 0 0 0 0
  2058. 2 5 1 0 0 0 0
  2059. 5 6 1 0 0 0 0
  2060. 5 7 1 0 0 0 0
  2061. 5 8 1 0 0 0 0
  2062. 8 9 1 0 0 0 0
  2063. 8 10 1 0 0 0 0
  2064. 8 11 1 0 0 0 0
  2065. 11 12 1 0 0 0 0
  2066. 11 13 1 0 0 0 0
  2067. M END
  2068. $$$$
  2069. dan096.sdf
  2070. MOE2004 3D
  2071. 14 13 0 0 0 0 0 0 0 0999 V2000
  2072. 1.8060 -0.5640 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
  2073. 1.8360 -1.1910 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0
  2074. 1.8380 -1.1990 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0
  2075. 0.6020 0.3640 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
  2076. 0.6360 1.0170 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  2077. 0.6330 1.0210 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0
  2078. -0.7040 -0.4280 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
  2079. -0.7450 -1.0820 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0
  2080. -0.7480 -1.0750 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
  2081. -1.9150 0.4900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  2082. -2.8380 -0.0980 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  2083. -1.9210 1.1280 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  2084. -1.9240 1.1350 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0
  2085. 3.4440 0.4810 -0.0010 Br 0 0 0 0 0 0 0 0 0 0 0 0
  2086. 1 2 1 0 0 0 0
  2087. 1 3 1 0 0 0 0
  2088. 1 4 1 0 0 0 0
  2089. 1 14 1 0 0 0 0
  2090. 4 5 1 0 0 0 0
  2091. 4 6 1 0 0 0 0
  2092. 4 7 1 0 0 0 0
  2093. 7 8 1 0 0 0 0
  2094. 7 9 1 0 0 0 0
  2095. 7 10 1 0 0 0 0
  2096. 10 11 1 0 0 0 0
  2097. 10 12 1 0 0 0 0
  2098. 10 13 1 0 0 0 0
  2099. M END
  2100. $$$$
  2101. dan097.sdf
  2102. MOE2004 3D
  2103. 14 13 0 0 1 0 0 0 0 0999 V2000
  2104. -1.0810 -1.1800 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0
  2105. -0.7840 -1.0260 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0
  2106. -0.5060 -2.0220 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0
  2107. -2.1360 -1.4750 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0
  2108. -0.8720 0.0640 0.5360 C 0 0 3 0 0 0 0 0 0 0 0 0
  2109. 0.5910 0.4800 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0
  2110. 1.0860 -0.2640 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0
  2111. 0.6430 1.4290 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0
  2112. 1.4040 0.6100 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0
  2113. 1.4870 -0.3480 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0
  2114. 0.9700 1.3420 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  2115. 2.4210 0.9410 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0
  2116. -1.9010 1.5380 -0.2360 Br 0 0 0 0 0 0 0 0 0 0 0 0
  2117. -1.3230 -0.0900 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  2118. 1 2 1 0 0 0 0
  2119. 1 3 1 0 0 0 0
  2120. 1 4 1 0 0 0 0
  2121. 1 5 1 0 0 0 0
  2122. 5 6 1 0 0 0 0
  2123. 5 13 1 0 0 0 0
  2124. 5 14 1 0 0 0 0
  2125. 6 7 1 0 0 0 0
  2126. 6 8 1 0 0 0 0
  2127. 6 9 1 0 0 0 0
  2128. 9 10 1 0 0 0 0
  2129. 9 11 1 0 0 0 0
  2130. 9 12 1 0 0 0 0
  2131. M END
  2132. $$$$
  2133. dan098.sdf
  2134. MOE2004 3D
  2135. 14 13 0 0 0 0 0 0 0 0999 V2000
  2136. -1.9150 0.4580 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  2137. -1.9350 1.0980 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  2138. -2.8250 -0.1490 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  2139. -1.9360 1.1010 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
  2140. -0.6840 -0.4340 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  2141. -0.7130 -1.0840 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0
  2142. -0.7110 -1.0850 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  2143. 0.6050 0.3870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  2144. 0.6240 1.0410 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0
  2145. 0.6250 1.0370 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
  2146. 1.8330 -0.5170 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  2147. 1.8550 -1.1570 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  2148. 1.8530 -1.1540 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0
  2149. 3.3230 0.4560 -0.0010 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  2150. 1 2 1 0 0 0 0
  2151. 1 3 1 0 0 0 0
  2152. 1 4 1 0 0 0 0
  2153. 1 5 1 0 0 0 0
  2154. 5 6 1 0 0 0 0
  2155. 5 7 1 0 0 0 0
  2156. 5 8 1 0 0 0 0
  2157. 8 9 1 0 0 0 0
  2158. 8 10 1 0 0 0 0
  2159. 8 11 1 0 0 0 0
  2160. 11 12 1 0 0 0 0
  2161. 11 13 1 0 0 0 0
  2162. 11 14 1 0 0 0 0
  2163. M END
  2164. $$$$
  2165. dan099.sdf
  2166. MOE2004 3D
  2167. 14 13 0 0 1 0 0 0 0 0999 V2000
  2168. -1.2310 1.0410 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0
  2169. -0.8860 0.9490 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0
  2170. -0.7870 1.9470 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0
  2171. -2.3160 1.1880 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0
  2172. -0.8700 -0.1800 -0.5110 C 0 0 3 0 0 0 0 0 0 0 0 0
  2173. 0.6420 -0.3570 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0
  2174. 1.0250 0.5060 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
  2175. 0.8200 -1.2310 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0
  2176. 1.4660 -0.5070 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0
  2177. 1.3980 0.3840 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
  2178. 1.1520 -1.3730 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0
  2179. 2.5220 -0.6480 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0
  2180. -1.5950 -1.6430 0.2230 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  2181. -1.3400 -0.0760 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0
  2182. 1 2 1 0 0 0 0
  2183. 1 3 1 0 0 0 0
  2184. 1 4 1 0 0 0 0
  2185. 1 5 1 0 0 0 0
  2186. 5 6 1 0 0 0 0
  2187. 5 13 1 0 0 0 0
  2188. 5 14 1 0 0 0 0
  2189. 6 7 1 0 0 0 0
  2190. 6 8 1 0 0 0 0
  2191. 6 9 1 0 0 0 0
  2192. 9 10 1 0 0 0 0
  2193. 9 11 1 0 0 0 0
  2194. 9 12 1 0 0 0 0
  2195. M END
  2196. $$$$
  2197. dan100.sdf
  2198. MOE2004 3D
  2199. 14 13 0 0 0 0 0 0 0 0999 V2000
  2200. -0.1140 1.4510 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0
  2201. 0.2370 1.9680 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0
  2202. 0.2380 2.0180 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0
  2203. -1.2090 1.4990 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0
  2204. 0.3740 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2205. -0.1150 -0.7610 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0
  2206. 0.2350 -1.7990 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0
  2207. 0.2390 -0.2940 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0
  2208. -1.2090 -0.7840 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  2209. -0.1140 -0.6900 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
  2210. 0.2380 -1.7260 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  2211. -1.2090 -0.7130 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0
  2212. 0.2370 -0.1700 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0
  2213. 2.1700 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  2214. 1 2 1 0 0 0 0
  2215. 1 3 1 0 0 0 0
  2216. 1 4 1 0 0 0 0
  2217. 1 5 1 0 0 0 0
  2218. 5 6 1 0 0 0 0
  2219. 5 10 1 0 0 0 0
  2220. 5 14 1 0 0 0 0
  2221. 6 7 1 0 0 0 0
  2222. 6 8 1 0 0 0 0
  2223. 6 9 1 0 0 0 0
  2224. 10 11 1 0 0 0 0
  2225. 10 12 1 0 0 0 0
  2226. 10 13 1 0 0 0 0
  2227. M END
  2228. $$$$
  2229. dan101.sdf
  2230. MOE2004 3D
  2231. 14 13 0 0 0 0 0 0 0 0999 V2000
  2232. -1.2570 -0.7830 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
  2233. -1.1890 -1.8110 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0
  2234. -1.4550 -0.8250 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0
  2235. -2.1190 -0.3130 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0
  2236. 0.0280 -0.0080 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0
  2237. 0.1660 -0.0010 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0
  2238. -0.1200 1.4410 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  2239. 0.7410 2.0500 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0
  2240. -1.0080 1.9050 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0
  2241. -0.2200 1.4950 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0
  2242. 1.2250 -0.7160 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0
  2243. 1.1630 -0.6790 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0
  2244. 1.2650 -1.7680 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0
  2245. 2.7800 0.0140 -0.2180 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  2246. 1 2 1 0 0 0 0
  2247. 1 3 1 0 0 0 0
  2248. 1 4 1 0 0 0 0
  2249. 1 5 1 0 0 0 0
  2250. 5 6 1 0 0 0 0
  2251. 5 7 1 0 0 0 0
  2252. 5 11 1 0 0 0 0
  2253. 7 8 1 0 0 0 0
  2254. 7 9 1 0 0 0 0
  2255. 7 10 1 0 0 0 0
  2256. 11 12 1 0 0 0 0
  2257. 11 13 1 0 0 0 0
  2258. 11 14 1 0 0 0 0
  2259. M END
  2260. $$$$
  2261. dan102.sdf
  2262. MOE2004 3D
  2263. 15 14 0 0 0 0 0 0 0 0999 V2000
  2264. -2.1100 -0.3370 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0
  2265. -2.1560 -0.9730 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0
  2266. -2.9990 0.3020 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  2267. -2.1510 -0.9810 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
  2268. -0.8490 0.5120 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0
  2269. -0.8510 1.1570 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0
  2270. -0.8570 1.1690 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0
  2271. 0.4100 -0.3520 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0
  2272. 0.4130 -1.0060 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0
  2273. 0.4200 -1.0210 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0
  2274. 1.6760 0.4970 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0
  2275. 1.7170 1.1310 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0
  2276. 1.7270 1.1430 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0
  2277. 2.8220 -0.3450 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0
  2278. 2.7880 -0.8960 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0
  2279. 1 2 1 0 0 0 0
  2280. 1 3 1 0 0 0 0
  2281. 1 4 1 0 0 0 0
  2282. 1 5 1 0 0 0 0
  2283. 5 6 1 0 0 0 0
  2284. 5 7 1 0 0 0 0
  2285. 5 8 1 0 0 0 0
  2286. 8 9 1 0 0 0 0
  2287. 8 10 1 0 0 0 0
  2288. 8 11 1 0 0 0 0
  2289. 11 12 1 0 0 0 0
  2290. 11 13 1 0 0 0 0
  2291. 11 14 1 0 0 0 0
  2292. 14 15 1 0 0 0 0
  2293. M END
  2294. $$$$
  2295. dan103.sdf
  2296. MOE2004 3D
  2297. 15 14 0 0 1 0 0 0 0 0999 V2000
  2298. -1.8910 0.5680 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0
  2299. -2.0500 0.5890 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  2300. -1.8560 1.5980 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
  2301. -2.7650 0.0730 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  2302. -0.6190 -0.1920 -0.2950 C 0 0 3 0 0 0 0 0 0 0 0 0
  2303. 0.6140 0.4750 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0
  2304. 0.5420 0.4430 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0
  2305. 0.6520 1.5300 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
  2306. 1.9190 -0.1930 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  2307. 1.9770 -1.2210 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0
  2308. 2.0260 -0.2100 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0
  2309. 2.7700 0.3560 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0
  2310. -0.7630 -1.5240 0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0
  2311. -0.0360 -2.0550 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0
  2312. -0.5210 -0.2380 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0
  2313. 1 2 1 0 0 0 0
  2314. 1 3 1 0 0 0 0
  2315. 1 4 1 0 0 0 0
  2316. 1 5 1 0 0 0 0
  2317. 5 6 1 0 0 0 0
  2318. 5 13 1 0 0 0 0
  2319. 5 15 1 0 0 0 0
  2320. 6 7 1 0 0 0 0
  2321. 6 8 1 0 0 0 0
  2322. 6 9 1 0 0 0 0
  2323. 9 10 1 0 0 0 0
  2324. 9 11 1 0 0 0 0
  2325. 9 12 1 0 0 0 0
  2326. 13 14 1 0 0 0 0
  2327. M END
  2328. $$$$
  2329. dan104.sdf
  2330. MOE2004 3D
  2331. 15 14 0 0 0 0 0 0 0 0999 V2000
  2332. -2.3990 0.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2333. -2.1280 1.5140 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  2334. -3.0240 0.2550 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0
  2335. -3.0220 0.2590 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  2336. -1.1850 -0.4590 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  2337. -1.1940 -1.0960 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  2338. -1.1940 -1.0980 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  2339. 0.0000 0.3430 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  2340. 1.1850 -0.4590 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  2341. 1.1940 -1.0960 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  2342. 1.1940 -1.0980 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  2343. 2.3990 0.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2344. 3.0240 0.2570 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0
  2345. 2.1280 1.5140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  2346. 3.0220 0.2570 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  2347. 1 2 1 0 0 0 0
  2348. 1 3 1 0 0 0 0
  2349. 1 4 1 0 0 0 0
  2350. 1 5 1 0 0 0 0
  2351. 5 6 1 0 0 0 0
  2352. 5 7 1 0 0 0 0
  2353. 5 8 1 0 0 0 0
  2354. 8 9 1 0 0 0 0
  2355. 9 10 1 0 0 0 0
  2356. 9 11 1 0 0 0 0
  2357. 9 12 1 0 0 0 0
  2358. 12 13 1 0 0 0 0
  2359. 12 14 1 0 0 0 0
  2360. 12 15 1 0 0 0 0
  2361. M END
  2362. $$$$
  2363. dan105.sdf
  2364. MOE2004 3D
  2365. 15 14 0 0 0 0 0 0 0 0999 V2000
  2366. 1.1020 -0.6730 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0
  2367. 1.1850 -1.7170 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0
  2368. 1.0630 -0.6620 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  2369. -0.1400 -0.0070 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0
  2370. -0.0310 0.0100 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0
  2371. -0.2800 1.4420 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  2372. 0.5850 2.0420 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0
  2373. -0.3710 1.5020 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0
  2374. -1.1690 1.9090 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
  2375. -1.3960 -0.8040 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
  2376. -1.3190 -1.8330 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0
  2377. -2.2830 -0.3550 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
  2378. -1.5560 -0.8420 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0
  2379. 2.2870 0.0040 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0
  2380. 2.3210 -0.0160 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0
  2381. 1 2 1 0 0 0 0
  2382. 1 3 1 0 0 0 0
  2383. 1 4 1 0 0 0 0
  2384. 1 14 1 0 0 0 0
  2385. 4 5 1 0 0 0 0
  2386. 4 6 1 0 0 0 0
  2387. 4 10 1 0 0 0 0
  2388. 6 7 1 0 0 0 0
  2389. 6 8 1 0 0 0 0
  2390. 6 9 1 0 0 0 0
  2391. 10 11 1 0 0 0 0
  2392. 10 12 1 0 0 0 0
  2393. 10 13 1 0 0 0 0
  2394. 14 15 1 0 0 0 0
  2395. M END
  2396. $$$$
  2397. dan106.sdf
  2398. MOE2004 3D
  2399. 15 14 0 0 0 0 0 0 0 0999 V2000
  2400. -1.2780 0.6440 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
  2401. -2.1650 0.1130 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
  2402. -1.3410 0.7270 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
  2403. -1.3300 1.6530 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  2404. 0.0020 -0.0700 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0
  2405. 1.2420 0.7110 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0
  2406. 1.2420 1.7200 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  2407. 1.3010 0.7970 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  2408. 2.1570 0.2260 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  2409. 0.0390 -1.4940 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0
  2410. 0.9310 -2.0270 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0
  2411. 0.0390 -1.5040 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0
  2412. -0.8210 -2.0730 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0
  2413. 0.0050 -0.1620 -1.6610 O 0 0 0 0 0 0 0 0 0 0 0 0
  2414. -0.0210 0.7410 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0
  2415. 1 2 1 0 0 0 0
  2416. 1 3 1 0 0 0 0
  2417. 1 4 1 0 0 0 0
  2418. 1 5 1 0 0 0 0
  2419. 5 6 1 0 0 0 0
  2420. 5 10 1 0 0 0 0
  2421. 5 14 1 0 0 0 0
  2422. 6 7 1 0 0 0 0
  2423. 6 8 1 0 0 0 0
  2424. 6 9 1 0 0 0 0
  2425. 10 11 1 0 0 0 0
  2426. 10 12 1 0 0 0 0
  2427. 10 13 1 0 0 0 0
  2428. 14 15 1 0 0 0 0
  2429. M END
  2430. $$$$
  2431. dan107.sdf
  2432. MOE2004 3D
  2433. 15 14 0 0 0 0 0 0 0 0999 V2000
  2434. -2.3220 0.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2435. -2.1440 1.2100 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  2436. -2.9220 -0.1100 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  2437. -2.9250 -0.1160 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  2438. -1.0300 -0.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2439. -1.0030 -1.3390 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0
  2440. -1.0040 -1.3390 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0
  2441. 0.2100 0.2090 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  2442. 0.2240 0.8440 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0
  2443. 0.2230 0.8450 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0
  2444. 1.3660 -0.6330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  2445. 2.5840 0.1110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2446. 2.4230 1.1950 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
  2447. 3.1620 -0.1690 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
  2448. 3.1580 -0.1620 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  2449. 1 2 1 0 0 0 0
  2450. 1 3 1 0 0 0 0
  2451. 1 4 1 0 0 0 0
  2452. 1 5 1 0 0 0 0
  2453. 5 6 1 0 0 0 0
  2454. 5 7 1 0 0 0 0
  2455. 5 8 1 0 0 0 0
  2456. 8 9 1 0 0 0 0
  2457. 8 10 1 0 0 0 0
  2458. 8 11 1 0 0 0 0
  2459. 11 12 1 0 0 0 0
  2460. 12 13 1 0 0 0 0
  2461. 12 14 1 0 0 0 0
  2462. 12 15 1 0 0 0 0
  2463. M END
  2464. $$$$
  2465. dan108.sdf
  2466. MOE2004 3D
  2467. 16 15 0 0 1 0 0 0 0 0999 V2000
  2468. 2.9070 -0.1570 -0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0
  2469. 3.6270 0.4550 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
  2470. 1.6910 0.4620 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0
  2471. 1.6250 1.4410 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0
  2472. 1.7230 0.6020 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0
  2473. 0.5260 -0.4340 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0
  2474. 0.5250 -0.5280 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0
  2475. 0.6900 -1.4450 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0
  2476. -0.8170 0.1120 0.2680 C 0 0 3 0 0 0 0 0 0 0 0 0
  2477. -1.9680 -0.7960 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0
  2478. -2.0410 -0.8630 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0
  2479. -1.8470 -1.8050 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  2480. -2.9220 -0.3930 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0
  2481. -1.0230 1.4090 -0.2870 O 0 0 0 0 0 0 0 0 0 0 0 0
  2482. -1.8910 1.7270 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
  2483. -0.8050 0.2120 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  2484. 1 2 1 0 0 0 0
  2485. 1 3 1 0 0 0 0
  2486. 3 4 1 0 0 0 0
  2487. 3 5 1 0 0 0 0
  2488. 3 6 1 0 0 0 0
  2489. 6 7 1 0 0 0 0
  2490. 6 8 1 0 0 0 0
  2491. 6 9 1 0 0 0 0
  2492. 9 10 1 0 0 0 0
  2493. 9 14 1 0 0 0 0
  2494. 9 16 1 0 0 0 0
  2495. 10 11 1 0 0 0 0
  2496. 10 12 1 0 0 0 0
  2497. 10 13 1 0 0 0 0
  2498. 14 15 1 0 0 0 0
  2499. M END
  2500. $$$$
  2501. dan109.sdf
  2502. MOE2004 3D
  2503. 16 15 0 0 0 0 0 0 0 0999 V2000
  2504. 2.8610 0.2810 -0.1960 O 0 0 0 0 0 0 0 0 0 0 0 0
  2505. 3.3590 1.0340 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  2506. 1.5110 0.4270 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0
  2507. 1.1370 1.3820 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
  2508. 1.4890 0.4460 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0
  2509. 0.7010 -0.7450 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0
  2510. 1.1790 -1.6800 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  2511. 0.7490 -0.7480 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0
  2512. -0.7550 -0.7510 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0
  2513. -1.2300 -1.6830 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0
  2514. -0.8020 -0.7720 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0
  2515. -1.5690 0.4270 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0
  2516. -1.2060 1.3810 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0
  2517. -1.5320 0.4720 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
  2518. -2.9310 0.2810 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0
  2519. -2.9620 0.2470 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0
  2520. 1 2 1 0 0 0 0
  2521. 1 3 1 0 0 0 0
  2522. 3 4 1 0 0 0 0
  2523. 3 5 1 0 0 0 0
  2524. 3 6 1 0 0 0 0
  2525. 6 7 1 0 0 0 0
  2526. 6 8 1 0 0 0 0
  2527. 6 9 1 0 0 0 0
  2528. 9 10 1 0 0 0 0
  2529. 9 11 1 0 0 0 0
  2530. 9 12 1 0 0 0 0
  2531. 12 13 1 0 0 0 0
  2532. 12 14 1 0 0 0 0
  2533. 12 15 1 0 0 0 0
  2534. 15 16 1 0 0 0 0
  2535. M END
  2536. $$$$
  2537. dan110.sdf
  2538. MOE2004 3D
  2539. 16 15 0 0 1 0 0 0 0 0999 V2000
  2540. 1.6340 1.0630 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  2541. 2.6230 0.9190 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0
  2542. 1.7830 1.0860 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0
  2543. 1.2520 2.0370 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0
  2544. 0.6960 -0.0740 0.3220 C 0 0 3 0 0 0 0 0 0 0 0 0
  2545. 1.2840 -1.3130 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0
  2546. 2.1450 -1.3870 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0
  2547. -0.6960 0.0740 -0.3220 C 0 0 3 0 0 0 0 0 0 0 0 0
  2548. -1.2840 1.3130 0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0
  2549. -2.1450 1.3880 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0
  2550. -1.6340 -1.0630 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  2551. -2.6230 -0.9180 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  2552. -1.2530 -2.0360 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0
  2553. -1.7820 -1.0870 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0
  2554. 0.5990 -0.0810 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0
  2555. -0.5990 0.0810 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0
  2556. 1 2 1 0 0 0 0
  2557. 1 3 1 0 0 0 0
  2558. 1 4 1 0 0 0 0
  2559. 1 5 1 0 0 0 0
  2560. 5 6 1 0 0 0 0
  2561. 5 8 1 0 0 0 0
  2562. 5 15 1 0 0 0 0
  2563. 6 7 1 0 0 0 0
  2564. 8 9 1 0 0 0 0
  2565. 8 11 1 0 0 0 0
  2566. 8 16 1 0 0 0 0
  2567. 9 10 1 0 0 0 0
  2568. 11 12 1 0 0 0 0
  2569. 11 13 1 0 0 0 0
  2570. 11 14 1 0 0 0 0
  2571. M END
  2572. $$$$
  2573. dan111.sdf
  2574. MOE2004 3D
  2575. 16 15 0 0 0 0 0 0 0 0999 V2000
  2576. -1.2560 0.7290 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0
  2577. -1.3250 0.7030 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0
  2578. -1.2490 1.7800 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
  2579. 0.0000 0.0000 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0
  2580. 0.0000 -0.0080 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0
  2581. 1.2550 0.7290 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0
  2582. 1.2480 1.7800 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0
  2583. 1.3250 0.7040 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0
  2584. 0.0000 -1.4670 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0
  2585. -0.8800 -1.9960 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  2586. 0.8820 -1.9950 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0
  2587. -0.0010 -1.5510 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0
  2588. -2.4340 0.1280 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0
  2589. -2.3790 0.1670 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  2590. 2.4330 0.1280 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0
  2591. 2.3800 0.1680 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0
  2592. 1 2 1 0 0 0 0
  2593. 1 3 1 0 0 0 0
  2594. 1 4 1 0 0 0 0
  2595. 1 13 1 0 0 0 0
  2596. 4 5 1 0 0 0 0
  2597. 4 6 1 0 0 0 0
  2598. 4 9 1 0 0 0 0
  2599. 6 7 1 0 0 0 0
  2600. 6 8 1 0 0 0 0
  2601. 6 15 1 0 0 0 0
  2602. 9 10 1 0 0 0 0
  2603. 9 11 1 0 0 0 0
  2604. 9 12 1 0 0 0 0
  2605. 13 14 1 0 0 0 0
  2606. 15 16 1 0 0 0 0
  2607. M END
  2608. $$$$
  2609. dan112.sdf
  2610. MOE2004 3D
  2611. 15 14 0 0 0 0 0 0 0 0999 V2000
  2612. -2.1240 0.3910 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0
  2613. -2.1480 1.0310 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0
  2614. -3.0350 -0.2150 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
  2615. -2.1420 1.0340 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0
  2616. -0.8950 -0.5020 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0
  2617. -0.9220 -1.1520 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0
  2618. -0.9260 -1.1530 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0
  2619. 0.3970 0.3170 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
  2620. 0.4110 0.9630 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0
  2621. 0.4110 0.9720 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
  2622. 1.6230 -0.5940 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
  2623. 1.6240 -1.2330 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0
  2624. 1.6280 -1.2420 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0
  2625. 3.1520 0.3870 0.0800 S 0 0 0 0 0 0 0 0 0 0 0 0
  2626. 2.9460 0.9970 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0
  2627. 1 2 1 0 0 0 0
  2628. 1 3 1 0 0 0 0
  2629. 1 4 1 0 0 0 0
  2630. 1 5 1 0 0 0 0
  2631. 5 6 1 0 0 0 0
  2632. 5 7 1 0 0 0 0
  2633. 5 8 1 0 0 0 0
  2634. 8 9 1 0 0 0 0
  2635. 8 10 1 0 0 0 0
  2636. 8 11 1 0 0 0 0
  2637. 11 12 1 0 0 0 0
  2638. 11 13 1 0 0 0 0
  2639. 11 14 1 0 0 0 0
  2640. 14 15 1 0 0 0 0
  2641. M END
  2642. $$$$
  2643. dan113.sdf
  2644. MOE2004 3D
  2645. 15 14 0 0 1 0 0 0 0 0999 V2000
  2646. 1.8500 -0.3340 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0
  2647. 1.9660 -0.2690 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  2648. 1.9920 0.6640 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0
  2649. 2.6500 -0.9720 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0
  2650. 0.4920 -0.9140 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0
  2651. 0.4740 -1.9580 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0
  2652. 0.4060 -0.9290 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0
  2653. -0.6850 -0.1470 -0.3120 C 0 0 3 0 0 0 0 0 0 0 0 0
  2654. -2.2390 -1.0340 0.0710 S 0 0 0 0 0 0 0 0 0 0 0 0
  2655. -3.0450 -0.2710 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0
  2656. -0.8010 1.2910 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0
  2657. -1.6770 1.7950 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0
  2658. -0.8770 1.3350 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0
  2659. 0.0720 1.8800 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0
  2660. -0.5790 -0.1380 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
  2661. 1 2 1 0 0 0 0
  2662. 1 3 1 0 0 0 0
  2663. 1 4 1 0 0 0 0
  2664. 1 5 1 0 0 0 0
  2665. 5 6 1 0 0 0 0
  2666. 5 7 1 0 0 0 0
  2667. 5 8 1 0 0 0 0
  2668. 8 9 1 0 0 0 0
  2669. 8 11 1 0 0 0 0
  2670. 8 15 1 0 0 0 0
  2671. 9 10 1 0 0 0 0
  2672. 11 12 1 0 0 0 0
  2673. 11 13 1 0 0 0 0
  2674. 11 14 1 0 0 0 0
  2675. M END
  2676. $$$$
  2677. dan114.sdf
  2678. MOE2004 3D
  2679. 15 14 0 0 0 0 0 0 0 0999 V2000
  2680. -0.2820 0.9990 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0
  2681. 0.0460 0.7020 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0
  2682. 0.0680 2.0220 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0
  2683. -1.3770 1.0310 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0
  2684. 0.2180 0.0280 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  2685. -0.2790 -1.3940 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0
  2686. 0.0780 -2.1120 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0
  2687. 0.0460 -1.7440 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0
  2688. -1.3740 -1.4330 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0
  2689. -0.2520 0.4820 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0
  2690. 0.1020 -0.1890 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  2691. -1.3460 0.4950 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  2692. 0.0940 1.4950 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0
  2693. 2.0550 0.0240 -0.0630 S 0 0 0 0 0 0 0 0 0 0 0 0
  2694. 2.2030 -0.4060 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0
  2695. 1 2 1 0 0 0 0
  2696. 1 3 1 0 0 0 0
  2697. 1 4 1 0 0 0 0
  2698. 1 5 1 0 0 0 0
  2699. 5 6 1 0 0 0 0
  2700. 5 10 1 0 0 0 0
  2701. 5 14 1 0 0 0 0
  2702. 6 7 1 0 0 0 0
  2703. 6 8 1 0 0 0 0
  2704. 6 9 1 0 0 0 0
  2705. 10 11 1 0 0 0 0
  2706. 10 12 1 0 0 0 0
  2707. 10 13 1 0 0 0 0
  2708. 14 15 1 0 0 0 0
  2709. M END
  2710. $$$$
  2711. dan115.sdf
  2712. MOE2004 3D
  2713. 15 14 0 0 0 0 0 0 0 0999 V2000
  2714. -0.9450 -1.1690 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0
  2715. -1.3060 -1.2200 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0
  2716. -1.8180 -1.1730 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0
  2717. -0.3710 -2.0790 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0
  2718. -0.0890 0.0770 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0
  2719. 0.2010 0.0770 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  2720. -0.9290 1.3340 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0
  2721. -0.3430 2.2370 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0
  2722. -1.8020 1.3520 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0
  2723. -1.2880 1.3840 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0
  2724. 1.1510 0.0670 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0
  2725. 1.1730 0.9410 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
  2726. 1.1720 -0.8200 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  2727. 2.6980 0.0770 -0.3400 S 0 0 0 0 0 0 0 0 0 0 0 0
  2728. 2.4950 -1.0860 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0
  2729. 1 2 1 0 0 0 0
  2730. 1 3 1 0 0 0 0
  2731. 1 4 1 0 0 0 0
  2732. 1 5 1 0 0 0 0
  2733. 5 6 1 0 0 0 0
  2734. 5 7 1 0 0 0 0
  2735. 5 11 1 0 0 0 0
  2736. 7 8 1 0 0 0 0
  2737. 7 9 1 0 0 0 0
  2738. 7 10 1 0 0 0 0
  2739. 11 12 1 0 0 0 0
  2740. 11 13 1 0 0 0 0
  2741. 11 14 1 0 0 0 0
  2742. 14 15 1 0 0 0 0
  2743. M END
  2744. $$$$
  2745. dan116.sdf
  2746. MOE2004 3D
  2747. 15 14 0 0 0 0 0 0 0 0999 V2000
  2748. -2.4070 -0.6610 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0
  2749. -2.2530 -0.8580 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0
  2750. -3.4780 -0.7260 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  2751. -1.8970 -1.4220 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0
  2752. -1.8200 0.9970 -0.3730 S 0 0 0 0 0 0 0 0 0 0 0 0
  2753. -0.1260 0.9130 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0
  2754. -0.1710 0.6230 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0
  2755. 0.2840 1.9280 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0
  2756. 0.7710 -0.0350 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0
  2757. 0.7650 0.2330 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0
  2758. 0.4100 -1.0660 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0
  2759. 2.2050 0.0120 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0
  2760. 2.8320 -0.6790 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0
  2761. 2.6260 1.0160 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0
  2762. 2.2590 -0.2740 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0
  2763. 1 2 1 0 0 0 0
  2764. 1 3 1 0 0 0 0
  2765. 1 4 1 0 0 0 0
  2766. 1 5 1 0 0 0 0
  2767. 5 6 1 0 0 0 0
  2768. 6 7 1 0 0 0 0
  2769. 6 8 1 0 0 0 0
  2770. 6 9 1 0 0 0 0
  2771. 9 10 1 0 0 0 0
  2772. 9 11 1 0 0 0 0
  2773. 9 12 1 0 0 0 0
  2774. 12 13 1 0 0 0 0
  2775. 12 14 1 0 0 0 0
  2776. 12 15 1 0 0 0 0
  2777. M END
  2778. $$$$
  2779. dan117.sdf
  2780. MOE2004 3D
  2781. 12 12 0 0 0 0 0 0 0 0999 V2000
  2782. -1.7080 -0.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2783. -2.5300 -1.2720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  2784. -0.3340 -0.9310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2785. 0.0280 -1.9510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  2786. -1.8860 0.7970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2787. -2.8170 1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  2788. -0.3940 1.6420 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
  2789. 0.5010 0.1710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2790. 1.9930 0.1940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2791. 2.3940 1.2120 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  2792. 2.3760 -0.3210 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0
  2793. 2.3760 -0.3190 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
  2794. 1 2 1 0 0 0 0
  2795. 1 3 1 0 0 0 0
  2796. 1 5 2 0 0 0 0
  2797. 3 4 1 0 0 0 0
  2798. 3 8 2 0 0 0 0
  2799. 5 6 1 0 0 0 0
  2800. 5 7 1 0 0 0 0
  2801. 7 8 1 0 0 0 0
  2802. 8 9 1 0 0 0 0
  2803. 9 10 1 0 0 0 0
  2804. 9 11 1 0 0 0 0
  2805. 9 12 1 0 0 0 0
  2806. M END
  2807. $$$$
  2808. dan118.sdf
  2809. MOE2004 3D
  2810. 16 15 0 0 0 0 0 0 0 0999 V2000
  2811. -1.0090 1.2120 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0
  2812. -0.4750 2.0500 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0
  2813. -1.0510 1.3960 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0
  2814. -2.0370 1.2180 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0
  2815. -0.3250 -0.1130 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0
  2816. -0.4000 -0.2770 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0
  2817. -1.0050 -1.2850 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0
  2818. -2.0340 -1.4040 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0
  2819. -1.0430 -1.1430 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0
  2820. -0.4700 -2.2210 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0
  2821. 1.1630 -0.0620 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0
  2822. 2.0060 -0.2060 1.2820 O 0 0 0 0 0 0 0 0 0 0 0 0
  2823. 1.5820 0.1670 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0
  2824. 2.6750 0.1770 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0
  2825. 1.2120 -0.6400 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0
  2826. 1.2120 1.1320 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
  2827. 1 2 1 0 0 0 0
  2828. 1 3 1 0 0 0 0
  2829. 1 4 1 0 0 0 0
  2830. 1 5 1 0 0 0 0
  2831. 5 6 1 0 0 0 0
  2832. 5 7 1 0 0 0 0
  2833. 5 11 1 0 0 0 0
  2834. 7 8 1 0 0 0 0
  2835. 7 9 1 0 0 0 0
  2836. 7 10 1 0 0 0 0
  2837. 11 12 2 0 0 0 0
  2838. 11 13 1 0 0 0 0
  2839. 13 14 1 0 0 0 0
  2840. 13 15 1 0 0 0 0
  2841. 13 16 1 0 0 0 0
  2842. M END
  2843. $$$$
  2844. dan119.sdf
  2845. MOE2004 3D
  2846. 16 15 0 0 0 0 0 0 0 0999 V2000
  2847. 2.1870 -0.6070 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0
  2848. 2.2690 -0.5560 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0
  2849. 2.6580 -1.5380 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0
  2850. 2.7530 0.2280 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0
  2851. 0.7330 -0.5650 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0
  2852. 0.6880 -0.6500 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0
  2853. 0.2110 -1.4350 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0
  2854. 0.0470 0.7270 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0
  2855. 0.0940 0.8070 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0
  2856. 0.5940 1.5860 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0
  2857. -1.4040 0.8100 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0
  2858. -1.8020 1.8100 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  2859. -1.4830 0.6310 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0
  2860. -2.2780 -0.1710 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0
  2861. -2.2610 -0.0990 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0
  2862. -3.0050 -0.9790 -0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0
  2863. 1 2 1 0 0 0 0
  2864. 1 3 1 0 0 0 0
  2865. 1 4 1 0 0 0 0
  2866. 1 5 1 0 0 0 0
  2867. 5 6 1 0 0 0 0
  2868. 5 7 1 0 0 0 0
  2869. 5 8 1 0 0 0 0
  2870. 8 9 1 0 0 0 0
  2871. 8 10 1 0 0 0 0
  2872. 8 11 1 0 0 0 0
  2873. 11 12 1 0 0 0 0
  2874. 11 13 1 0 0 0 0
  2875. 11 14 1 0 0 0 0
  2876. 14 15 1 0 0 0 0
  2877. 14 16 2 0 0 0 0
  2878. M END
  2879. $$$$
  2880. dan120.sdf
  2881. MOE2004 3D
  2882. 16 15 0 0 0 0 0 0 0 0999 V2000
  2883. 1.6890 -0.7840 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0
  2884. 1.9220 -1.6890 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0
  2885. 0.9580 -1.0430 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0
  2886. 2.6040 -0.4570 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0
  2887. 1.1680 0.3170 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0
  2888. 1.9590 0.5890 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  2889. 0.9590 1.2110 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0
  2890. -0.0700 -0.1050 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  2891. 0.1360 -1.0130 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0
  2892. -0.3410 0.6720 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0
  2893. -1.2770 -0.3580 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0
  2894. -1.7420 -1.4860 0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0
  2895. -1.8750 0.8220 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0
  2896. -2.8620 0.5530 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0
  2897. -1.9940 1.6590 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0
  2898. -1.2330 1.1120 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0
  2899. 1 2 1 0 0 0 0
  2900. 1 3 1 0 0 0 0
  2901. 1 4 1 0 0 0 0
  2902. 1 5 1 0 0 0 0
  2903. 5 6 1 0 0 0 0
  2904. 5 7 1 0 0 0 0
  2905. 5 8 1 0 0 0 0
  2906. 8 9 1 0 0 0 0
  2907. 8 10 1 0 0 0 0
  2908. 8 11 1 0 0 0 0
  2909. 11 12 2 0 0 0 0
  2910. 11 13 1 0 0 0 0
  2911. 13 14 1 0 0 0 0
  2912. 13 15 1 0 0 0 0
  2913. 13 16 1 0 0 0 0
  2914. M END
  2915. $$$$
  2916. dan121.sdf
  2917. MOE2004 3D
  2918. 16 15 0 0 0 0 0 0 0 0999 V2000
  2919. -1.8590 -0.5450 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0
  2920. -1.9830 -0.0230 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
  2921. -2.8330 -0.9370 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0
  2922. -1.1910 -1.3940 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0
  2923. -1.3050 0.3860 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0
  2924. -1.1630 -0.1480 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0
  2925. -2.0140 1.1960 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0
  2926. 0.0020 1.0090 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0
  2927. 1.2890 0.3590 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0
  2928. 1.9960 1.1570 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
  2929. 1.1130 -0.2100 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0
  2930. 1.8700 -0.5350 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0
  2931. 2.8280 -0.9520 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  2932. 2.0350 0.0230 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0
  2933. 1.1980 -1.3670 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0
  2934. 0.0160 1.9810 0.6050 O 0 0 0 0 0 0 0 0 0 0 0 0
  2935. 1 2 1 0 0 0 0
  2936. 1 3 1 0 0 0 0
  2937. 1 4 1 0 0 0 0
  2938. 1 5 1 0 0 0 0
  2939. 5 6 1 0 0 0 0
  2940. 5 7 1 0 0 0 0
  2941. 5 8 1 0 0 0 0
  2942. 8 9 1 0 0 0 0
  2943. 8 16 2 0 0 0 0
  2944. 9 10 1 0 0 0 0
  2945. 9 11 1 0 0 0 0
  2946. 9 12 1 0 0 0 0
  2947. 12 13 1 0 0 0 0
  2948. 12 14 1 0 0 0 0
  2949. 12 15 1 0 0 0 0
  2950. M END
  2951. $$$$
  2952. dan122.sdf
  2953. MOE2004 3D
  2954. 17 16 0 0 0 0 0 0 0 0999 V2000
  2955. -2.6040 -0.3530 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
  2956. -3.0500 0.6100 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0
  2957. -2.7550 -0.5180 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0
  2958. -3.1430 -1.1360 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0
  2959. -1.1260 -0.3880 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0
  2960. -1.0140 -0.2610 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0
  2961. -0.7230 -1.3750 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  2962. -0.3470 0.7060 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0
  2963. -0.4560 0.5560 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0
  2964. -0.7720 1.6870 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0
  2965. 1.1350 0.7040 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0
  2966. 1.6310 1.5440 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0
  2967. 1.2620 0.8080 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0
  2968. 1.7280 -0.5250 -0.4220 O 0 0 0 0 0 0 0 0 0 0 0 0
  2969. 3.0570 -0.6370 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0
  2970. 3.4160 -1.6080 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0
  2971. 3.7630 0.1850 0.4130 O 0 0 0 0 0 0 0 0 0 0 0 0
  2972. 1 2 1 0 0 0 0
  2973. 1 3 1 0 0 0 0
  2974. 1 4 1 0 0 0 0
  2975. 1 5 1 0 0 0 0
  2976. 5 6 1 0 0 0 0
  2977. 5 7 1 0 0 0 0
  2978. 5 8 1 0 0 0 0
  2979. 8 9 1 0 0 0 0
  2980. 8 10 1 0 0 0 0
  2981. 8 11 1 0 0 0 0
  2982. 11 12 1 0 0 0 0
  2983. 11 13 1 0 0 0 0
  2984. 11 14 1 0 0 0 0
  2985. 14 15 1 0 0 0 0
  2986. 15 16 1 0 0 0 0
  2987. 15 17 2 0 0 0 0
  2988. M END
  2989. $$$$
  2990. dan123.sdf
  2991. MOE2004 3D
  2992. 17 16 0 0 1 0 0 0 0 0999 V2000
  2993. 0.0910 1.5590 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0
  2994. 0.7360 2.3520 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0
  2995. -0.9410 1.9210 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0
  2996. 0.3800 1.3980 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
  2997. 0.2440 0.2840 -0.6290 C 0 0 3 0 0 0 0 0 0 0 0 0
  2998. -0.4920 -0.9390 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
  2999. -0.1230 -1.1770 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0
  3000. -0.2560 -1.8150 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0
  3001. -2.0020 -0.7650 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
  3002. -2.2870 0.0280 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0
  3003. -2.4090 -0.5240 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0
  3004. -2.4740 -1.6910 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0
  3005. 1.6390 -0.0150 -0.8690 O 0 0 0 0 0 0 0 0 0 0 0 0
  3006. 2.4640 -0.2940 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0
  3007. 1.9520 -0.2590 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  3008. 3.6510 -0.5580 0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0
  3009. -0.1720 0.4930 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0
  3010. 1 2 1 0 0 0 0
  3011. 1 3 1 0 0 0 0
  3012. 1 4 1 0 0 0 0
  3013. 1 5 1 0 0 0 0
  3014. 5 6 1 0 0 0 0
  3015. 5 13 1 0 0 0 0
  3016. 5 17 1 0 0 0 0
  3017. 6 7 1 0 0 0 0
  3018. 6 8 1 0 0 0 0
  3019. 6 9 1 0 0 0 0
  3020. 9 10 1 0 0 0 0
  3021. 9 11 1 0 0 0 0
  3022. 9 12 1 0 0 0 0
  3023. 13 14 1 0 0 0 0
  3024. 14 15 1 0 0 0 0
  3025. 14 16 2 0 0 0 0
  3026. M END
  3027. $$$$
  3028. dan124.sdf
  3029. MOE2004 3D
  3030. 17 16 0 0 0 0 0 0 0 0999 V2000
  3031. -0.4040 -0.4660 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0
  3032. -0.1590 0.2350 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
  3033. 0.2220 -1.3490 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0
  3034. -1.4480 -0.7770 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0
  3035. -0.1590 0.1720 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0
  3036. -1.1100 1.3630 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
  3037. -0.9380 2.1170 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0
  3038. -2.1610 1.0580 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0
  3039. -0.9380 1.8670 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  3040. -0.4050 -0.8290 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0
  3041. -0.1590 -0.3840 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0
  3042. -1.4480 -1.1610 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0
  3043. 0.2220 -1.7200 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0
  3044. 1.1750 0.7310 0.1060 O 0 0 0 0 0 0 0 0 0 0 0 0
  3045. 2.2710 -0.0680 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0
  3046. 2.0180 -1.1270 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0
  3047. 3.4210 0.3400 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0
  3048. 1 2 1 0 0 0 0
  3049. 1 3 1 0 0 0 0
  3050. 1 4 1 0 0 0 0
  3051. 1 5 1 0 0 0 0
  3052. 5 6 1 0 0 0 0
  3053. 5 10 1 0 0 0 0
  3054. 5 14 1 0 0 0 0
  3055. 6 7 1 0 0 0 0
  3056. 6 8 1 0 0 0 0
  3057. 6 9 1 0 0 0 0
  3058. 10 11 1 0 0 0 0
  3059. 10 12 1 0 0 0 0
  3060. 10 13 1 0 0 0 0
  3061. 14 15 1 0 0 0 0
  3062. 15 16 1 0 0 0 0
  3063. 15 17 2 0 0 0 0
  3064. M END
  3065. $$$$
  3066. dan125.sdf
  3067. MOE2004 3D
  3068. 17 16 0 0 0 0 0 0 0 0999 V2000
  3069. 2.3000 -0.2520 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0
  3070. 2.8000 -1.2250 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0
  3071. 1.7540 -0.1610 -1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
  3072. 3.0610 0.5330 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
  3073. 1.3620 -0.1570 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0
  3074. 1.9360 -0.2760 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0
  3075. 0.8790 0.8210 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0
  3076. 0.4090 -1.2350 0.6230 O 0 0 0 0 0 0 0 0 0 0 0 0
  3077. -0.8070 -1.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  3078. -1.5320 -2.1640 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0
  3079. -1.2500 0.1440 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0
  3080. -1.9140 -0.0820 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0
  3081. -0.4140 0.6930 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0
  3082. -1.9990 0.9750 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0
  3083. -2.3400 1.9140 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  3084. -2.8760 0.4370 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0
  3085. -1.3690 1.2130 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0
  3086. 1 2 1 0 0 0 0
  3087. 1 3 1 0 0 0 0
  3088. 1 4 1 0 0 0 0
  3089. 1 5 1 0 0 0 0
  3090. 5 6 1 0 0 0 0
  3091. 5 7 1 0 0 0 0
  3092. 5 8 1 0 0 0 0
  3093. 8 9 1 0 0 0 0
  3094. 9 10 2 0 0 0 0
  3095. 9 11 1 0 0 0 0
  3096. 11 12 1 0 0 0 0
  3097. 11 13 1 0 0 0 0
  3098. 11 14 1 0 0 0 0
  3099. 14 15 1 0 0 0 0
  3100. 14 16 1 0 0 0 0
  3101. 14 17 1 0 0 0 0
  3102. M END
  3103. $$$$
  3104. dan126.sdf
  3105. MOE2004 3D
  3106. 17 16 0 0 0 0 0 0 0 0999 V2000
  3107. -1.5680 -1.1520 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  3108. -1.1610 -2.1450 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0
  3109. -2.1130 -0.8100 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0
  3110. -2.2890 -1.2590 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0
  3111. -0.4550 -0.1770 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0
  3112. 0.0480 -0.5590 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0
  3113. -1.0390 1.1910 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0
  3114. -0.2590 1.8820 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
  3115. -1.7690 1.1020 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0
  3116. -1.5460 1.6440 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  3117. 0.5730 -0.0690 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0
  3118. 0.1060 0.3610 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0
  3119. 0.9510 -1.0560 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0
  3120. 1.6610 0.7980 0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0
  3121. 2.6730 0.2170 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0
  3122. 3.4390 0.9800 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0
  3123. 2.7490 -0.9490 -0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0
  3124. 1 2 1 0 0 0 0
  3125. 1 3 1 0 0 0 0
  3126. 1 4 1 0 0 0 0
  3127. 1 5 1 0 0 0 0
  3128. 5 6 1 0 0 0 0
  3129. 5 7 1 0 0 0 0
  3130. 5 11 1 0 0 0 0
  3131. 7 8 1 0 0 0 0
  3132. 7 9 1 0 0 0 0
  3133. 7 10 1 0 0 0 0
  3134. 11 12 1 0 0 0 0
  3135. 11 13 1 0 0 0 0
  3136. 11 14 1 0 0 0 0
  3137. 14 15 1 0 0 0 0
  3138. 15 16 1 0 0 0 0
  3139. 15 17 2 0 0 0 0
  3140. M END
  3141. $$$$
  3142. dan127.sdf
  3143. MOE2004 3D
  3144. 17 16 0 0 0 0 0 0 0 0999 V2000
  3145. -2.6900 -0.6570 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0
  3146. -2.6030 -0.7400 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  3147. -2.6970 -1.6480 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0
  3148. -3.6330 -0.1560 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
  3149. -1.5490 0.1490 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0
  3150. -1.6780 1.2020 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0
  3151. -0.3660 -0.4700 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0
  3152. 0.8290 0.1890 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0
  3153. 0.6650 0.6440 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0
  3154. 1.2440 1.2550 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0
  3155. 0.4710 2.0230 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0
  3156. 2.1770 1.7430 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0
  3157. 1.3790 0.8190 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0
  3158. 1.9100 -0.8750 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0
  3159. 1.5990 -1.6460 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0
  3160. 2.0860 -1.3850 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
  3161. 2.8550 -0.4440 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0
  3162. 1 2 1 0 0 0 0
  3163. 1 3 1 0 0 0 0
  3164. 1 4 1 0 0 0 0
  3165. 1 5 1 0 0 0 0
  3166. 5 6 2 0 0 0 0
  3167. 5 7 1 0 0 0 0
  3168. 7 8 1 0 0 0 0
  3169. 8 9 1 0 0 0 0
  3170. 8 10 1 0 0 0 0
  3171. 8 14 1 0 0 0 0
  3172. 10 11 1 0 0 0 0
  3173. 10 12 1 0 0 0 0
  3174. 10 13 1 0 0 0 0
  3175. 14 15 1 0 0 0 0
  3176. 14 16 1 0 0 0 0
  3177. 14 17 1 0 0 0 0
  3178. M END
  3179. $$$$
  3180. dan128.sdf
  3181. MOE2004 3D
  3182. 17 16 0 0 0 0 0 0 0 0999 V2000
  3183. 2.1870 0.4370 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0
  3184. 2.7200 0.9280 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0
  3185. 1.7550 1.2110 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0
  3186. 2.9220 -0.1150 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0
  3187. 1.1190 -0.5100 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0
  3188. 1.6110 -1.3070 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0
  3189. 0.6150 -0.9830 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  3190. 0.1080 0.1870 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0
  3191. 0.6250 0.7870 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0
  3192. -0.4700 -0.5420 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0
  3193. -0.8170 1.1140 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0
  3194. -0.5540 2.3030 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0
  3195. -1.9390 0.5750 0.4550 O 0 0 0 0 0 0 0 0 0 0 0 0
  3196. -2.3700 -0.7650 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  3197. -1.6220 -1.4930 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0
  3198. -3.2850 -0.9430 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0
  3199. -2.6040 -0.8840 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0
  3200. 1 2 1 0 0 0 0
  3201. 1 3 1 0 0 0 0
  3202. 1 4 1 0 0 0 0
  3203. 1 5 1 0 0 0 0
  3204. 5 6 1 0 0 0 0
  3205. 5 7 1 0 0 0 0
  3206. 5 8 1 0 0 0 0
  3207. 8 9 1 0 0 0 0
  3208. 8 10 1 0 0 0 0
  3209. 8 11 1 0 0 0 0
  3210. 11 12 2 0 0 0 0
  3211. 11 13 1 0 0 0 0
  3212. 13 14 1 0 0 0 0
  3213. 14 15 1 0 0 0 0
  3214. 14 16 1 0 0 0 0
  3215. 14 17 1 0 0 0 0
  3216. M END
  3217. $$$$
  3218. dan129.sdf
  3219. MOE2004 3D
  3220. 17 16 0 0 0 0 0 0 0 0999 V2000
  3221. -0.5990 1.4350 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0
  3222. 0.3030 1.8650 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0
  3223. -1.4290 1.6270 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0
  3224. -0.8040 1.9740 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
  3225. -0.4350 -0.0660 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0
  3226. -0.2180 -0.5440 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  3227. -1.7430 -0.6520 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0
  3228. -1.6570 -1.7340 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  3229. -2.0190 -0.2050 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0
  3230. -2.5650 -0.4760 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0
  3231. 0.7110 -0.3530 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0
  3232. 0.5900 0.2250 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0
  3233. 0.7220 -1.4060 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0
  3234. 2.0670 -0.0270 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
  3235. 2.7260 0.9550 0.4390 O 0 0 0 0 0 0 0 0 0 0 0 0
  3236. 2.4870 -0.9410 -0.7760 O 0 0 0 0 0 0 0 0 0 0 0 0
  3237. 1.8630 -1.6790 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0
  3238. 1 2 1 0 0 0 0
  3239. 1 3 1 0 0 0 0
  3240. 1 4 1 0 0 0 0
  3241. 1 5 1 0 0 0 0
  3242. 5 6 1 0 0 0 0
  3243. 5 7 1 0 0 0 0
  3244. 5 11 1 0 0 0 0
  3245. 7 8 1 0 0 0 0
  3246. 7 9 1 0 0 0 0
  3247. 7 10 1 0 0 0 0
  3248. 11 12 1 0 0 0 0
  3249. 11 13 1 0 0 0 0
  3250. 11 14 1 0 0 0 0
  3251. 14 15 2 0 0 0 0
  3252. 14 16 1 0 0 0 0
  3253. 16 17 1 0 0 0 0
  3254. M END
  3255. $$$$
  3256. dan130.sdf
  3257. MOE2004 3D
  3258. 17 16 0 0 0 0 0 0 0 0999 V2000
  3259. -0.4850 0.6150 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0
  3260. -0.0870 0.1420 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0
  3261. -0.1640 1.6610 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
  3262. -1.5780 0.6090 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  3263. -0.0030 -0.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  3264. -0.4860 0.6130 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0
  3265. -0.0930 0.1360 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0
  3266. -1.5790 0.6110 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0
  3267. -0.1610 1.6580 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0
  3268. -0.5860 -1.5400 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  3269. -0.2630 -2.1040 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0
  3270. -0.2630 -2.1030 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  3271. -1.6820 -1.5240 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  3272. 1.5320 -0.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  3273. 2.1670 -1.2460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  3274. 2.1590 1.0040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  3275. 1.5710 1.7830 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  3276. 1 2 1 0 0 0 0
  3277. 1 3 1 0 0 0 0
  3278. 1 4 1 0 0 0 0
  3279. 1 5 1 0 0 0 0
  3280. 5 6 1 0 0 0 0
  3281. 5 10 1 0 0 0 0
  3282. 5 14 1 0 0 0 0
  3283. 6 7 1 0 0 0 0
  3284. 6 8 1 0 0 0 0
  3285. 6 9 1 0 0 0 0
  3286. 10 11 1 0 0 0 0
  3287. 10 12 1 0 0 0 0
  3288. 10 13 1 0 0 0 0
  3289. 14 15 2 0 0 0 0
  3290. 14 16 1 0 0 0 0
  3291. 16 17 1 0 0 0 0
  3292. M END
  3293. $$$$
  3294. dan131.sdf
  3295. MOE2004 3D
  3296. 17 16 0 0 0 0 0 0 0 0999 V2000
  3297. 2.2780 0.2830 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0
  3298. 2.2090 -0.1400 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0
  3299. 2.8810 -0.3940 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0
  3300. 2.8070 1.2380 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0
  3301. 0.8970 0.4850 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0
  3302. 0.3420 1.1960 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0
  3303. 1.0020 0.9360 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0
  3304. 0.1330 -0.8370 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0
  3305. 0.7220 -1.5460 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0
  3306. 0.0170 -1.2740 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
  3307. -1.2350 -0.6760 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0
  3308. -1.1580 -0.1640 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0
  3309. -1.6630 -1.6610 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0
  3310. -2.2160 0.0390 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0
  3311. -2.7930 -0.4930 1.1190 O 0 0 0 0 0 0 0 0 0 0 0 0
  3312. -2.3790 1.3490 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0
  3313. -1.8440 1.6590 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
  3314. 1 2 1 0 0 0 0
  3315. 1 3 1 0 0 0 0
  3316. 1 4 1 0 0 0 0
  3317. 1 5 1 0 0 0 0
  3318. 5 6 1 0 0 0 0
  3319. 5 7 1 0 0 0 0
  3320. 5 8 1 0 0 0 0
  3321. 8 9 1 0 0 0 0
  3322. 8 10 1 0 0 0 0
  3323. 8 11 1 0 0 0 0
  3324. 11 12 1 0 0 0 0
  3325. 11 13 1 0 0 0 0
  3326. 11 14 1 0 0 0 0
  3327. 14 15 2 0 0 0 0
  3328. 14 16 1 0 0 0 0
  3329. 16 17 1 0 0 0 0
  3330. M END
  3331. $$$$
  3332. dan132.sdf
  3333. MOE2004 3D
  3334. 17 16 0 0 0 0 0 0 0 0999 V2000
  3335. 2.1160 -0.6510 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0
  3336. 1.3600 -1.4030 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0
  3337. 2.8390 -0.6210 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3338. 2.6440 -0.9780 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0
  3339. 1.4900 0.7210 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0
  3340. 2.2820 1.4580 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0
  3341. 0.9750 1.0050 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0
  3342. 0.5120 0.7510 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0
  3343. 1.0250 0.4630 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0
  3344. 0.1260 1.7640 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3345. -0.5640 -0.1810 0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0
  3346. -1.6280 0.2750 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  3347. -1.7360 1.3860 -0.5010 O 0 0 0 0 0 0 0 0 0 0 0 0
  3348. -2.6640 -0.8040 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0
  3349. -2.9700 -1.1310 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
  3350. -3.5440 -0.4100 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0
  3351. -2.2640 -1.6430 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0
  3352. 1 2 1 0 0 0 0
  3353. 1 3 1 0 0 0 0
  3354. 1 4 1 0 0 0 0
  3355. 1 5 1 0 0 0 0
  3356. 5 6 1 0 0 0 0
  3357. 5 7 1 0 0 0 0
  3358. 5 8 1 0 0 0 0
  3359. 8 9 1 0 0 0 0
  3360. 8 10 1 0 0 0 0
  3361. 8 11 1 0 0 0 0
  3362. 11 12 1 0 0 0 0
  3363. 12 13 2 0 0 0 0
  3364. 12 14 1 0 0 0 0
  3365. 14 15 1 0 0 0 0
  3366. 14 16 1 0 0 0 0
  3367. 14 17 1 0 0 0 0
  3368. M END
  3369. $$$$
  3370. dan133.sdf
  3371. MOE2004 3D
  3372. 17 16 0 0 0 0 0 0 0 0999 V2000
  3373. 2.4260 0.3400 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
  3374. 2.8740 -0.5670 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0
  3375. 2.5480 0.3120 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0
  3376. 2.9850 1.2000 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0
  3377. 0.9590 0.4530 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0
  3378. 0.8760 0.5060 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0
  3379. 0.5650 1.3920 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0
  3380. 0.1500 -0.7340 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0
  3381. 0.1980 -0.7570 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0
  3382. 0.6100 -1.6650 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0
  3383. -1.3130 -0.7240 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0
  3384. -1.7730 -1.6670 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0
  3385. -1.3580 -0.7060 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0
  3386. -2.1110 0.4430 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0
  3387. -1.7420 1.4050 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0
  3388. -2.0740 0.4480 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0
  3389. -3.8210 0.3210 0.1690 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  3390. 1 2 1 0 0 0 0
  3391. 1 3 1 0 0 0 0
  3392. 1 4 1 0 0 0 0
  3393. 1 5 1 0 0 0 0
  3394. 5 6 1 0 0 0 0
  3395. 5 7 1 0 0 0 0
  3396. 5 8 1 0 0 0 0
  3397. 8 9 1 0 0 0 0
  3398. 8 10 1 0 0 0 0
  3399. 8 11 1 0 0 0 0
  3400. 11 12 1 0 0 0 0
  3401. 11 13 1 0 0 0 0
  3402. 11 14 1 0 0 0 0
  3403. 14 15 1 0 0 0 0
  3404. 14 16 1 0 0 0 0
  3405. 14 17 1 0 0 0 0
  3406. M END
  3407. $$$$
  3408. dan134.sdf
  3409. MOE2004 3D
  3410. 18 17 0 0 0 0 0 0 0 0999 V2000
  3411. 1.1690 -0.8470 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0
  3412. 1.2330 -1.5340 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0
  3413. 1.2290 -1.4540 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0
  3414. -0.1440 -0.0350 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
  3415. -0.2480 0.9120 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0
  3416. -0.1660 0.3610 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0
  3417. -1.2080 1.4400 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  3418. 0.5390 1.6740 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  3419. 2.3210 -0.0110 0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0
  3420. 2.3810 0.4590 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0
  3421. -1.3310 -1.0120 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0
  3422. -1.3300 -1.6160 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  3423. -1.3000 -1.6990 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0
  3424. -2.2880 -0.4790 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  3425. -0.2020 0.7980 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0
  3426. -0.1210 0.1600 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  3427. 0.6100 1.5320 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0
  3428. -1.1450 1.3500 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0
  3429. 1 2 1 0 0 0 0
  3430. 1 3 1 0 0 0 0
  3431. 1 4 1 0 0 0 0
  3432. 1 9 1 0 0 0 0
  3433. 4 5 1 0 0 0 0
  3434. 4 11 1 0 0 0 0
  3435. 4 15 1 0 0 0 0
  3436. 5 6 1 0 0 0 0
  3437. 5 7 1 0 0 0 0
  3438. 5 8 1 0 0 0 0
  3439. 9 10 1 0 0 0 0
  3440. 11 12 1 0 0 0 0
  3441. 11 13 1 0 0 0 0
  3442. 11 14 1 0 0 0 0
  3443. 15 16 1 0 0 0 0
  3444. 15 17 1 0 0 0 0
  3445. 15 18 1 0 0 0 0
  3446. M END
  3447. $$$$
  3448. dan135.sdf
  3449. MOE2004 3D
  3450. 18 17 0 0 0 0 0 0 0 0999 V2000
  3451. 2.3710 -0.4460 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0
  3452. 2.5470 -1.3430 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
  3453. 1.8930 -0.7750 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0
  3454. 3.3370 0.0040 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3455. 1.4980 0.5410 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0
  3456. 2.0230 0.8600 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0
  3457. 1.3030 1.4360 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0
  3458. 0.2800 -0.0850 0.8490 O 0 0 0 0 0 0 0 0 0 0 0 0
  3459. -0.7640 -0.0790 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0
  3460. -0.3460 -0.2290 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  3461. -1.6930 -1.2430 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0
  3462. -2.5200 -1.3030 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0
  3463. -1.1420 -2.1890 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  3464. -2.1090 -1.1520 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0
  3465. -1.5260 1.2420 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  3466. -0.8760 2.0850 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  3467. -2.3690 1.2440 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0
  3468. -1.9060 1.4330 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0
  3469. 1 2 1 0 0 0 0
  3470. 1 3 1 0 0 0 0
  3471. 1 4 1 0 0 0 0
  3472. 1 5 1 0 0 0 0
  3473. 5 6 1 0 0 0 0
  3474. 5 7 1 0 0 0 0
  3475. 5 8 1 0 0 0 0
  3476. 8 9 1 0 0 0 0
  3477. 9 10 1 0 0 0 0
  3478. 9 11 1 0 0 0 0
  3479. 9 15 1 0 0 0 0
  3480. 11 12 1 0 0 0 0
  3481. 11 13 1 0 0 0 0
  3482. 11 14 1 0 0 0 0
  3483. 15 16 1 0 0 0 0
  3484. 15 17 1 0 0 0 0
  3485. 15 18 1 0 0 0 0
  3486. M END
  3487. $$$$
  3488. dan136.sdf
  3489. MOE2004 3D
  3490. 18 17 0 0 0 0 0 0 0 0999 V2000
  3491. 3.0070 0.1720 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0
  3492. 3.4390 -0.8300 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
  3493. 2.9810 0.4240 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
  3494. 3.6630 0.8810 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3495. 1.6110 0.2010 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0
  3496. 1.6510 -0.0660 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0
  3497. 1.1910 1.2070 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  3498. 0.8040 -0.7460 -0.3530 O 0 0 0 0 0 0 0 0 0 0 0 0
  3499. -0.5340 -0.8380 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0
  3500. -0.5310 -0.8520 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0
  3501. -0.9290 -1.8040 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
  3502. -1.4120 0.2840 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0
  3503. -1.3510 0.2980 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0
  3504. -1.0390 1.2580 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0
  3505. -2.8600 0.1300 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0
  3506. -3.4660 0.9450 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0
  3507. -3.2800 -0.8150 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0
  3508. -2.9480 0.1520 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0
  3509. 1 2 1 0 0 0 0
  3510. 1 3 1 0 0 0 0
  3511. 1 4 1 0 0 0 0
  3512. 1 5 1 0 0 0 0
  3513. 5 6 1 0 0 0 0
  3514. 5 7 1 0 0 0 0
  3515. 5 8 1 0 0 0 0
  3516. 8 9 1 0 0 0 0
  3517. 9 10 1 0 0 0 0
  3518. 9 11 1 0 0 0 0
  3519. 9 12 1 0 0 0 0
  3520. 12 13 1 0 0 0 0
  3521. 12 14 1 0 0 0 0
  3522. 12 15 1 0 0 0 0
  3523. 15 16 1 0 0 0 0
  3524. 15 17 1 0 0 0 0
  3525. 15 18 1 0 0 0 0
  3526. M END
  3527. $$$$
  3528. dan137.sdf
  3529. MOE2004 3D
  3530. 18 17 0 0 1 0 0 0 0 0999 V2000
  3531. -0.1810 -1.4460 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0
  3532. -0.9490 -2.1880 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0
  3533. -0.1260 -1.3750 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0
  3534. -0.5110 -0.0820 0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0
  3535. 0.3630 1.0690 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0
  3536. 0.0070 2.0140 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0
  3537. 0.2410 1.1550 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0
  3538. 1.8460 0.9480 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0
  3539. 2.3640 1.8750 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0
  3540. 2.0080 0.7690 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0
  3541. 2.3170 0.1410 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0
  3542. -1.9860 0.2480 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  3543. -2.2080 0.3250 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
  3544. -2.6350 -0.5250 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0
  3545. -2.2580 1.1980 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0
  3546. 1.0600 -1.9540 0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0
  3547. 0.9970 -2.0250 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  3548. -0.3490 -0.1460 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0
  3549. 1 2 1 0 0 0 0
  3550. 1 3 1 0 0 0 0
  3551. 1 4 1 0 0 0 0
  3552. 1 16 1 0 0 0 0
  3553. 4 5 1 0 0 0 0
  3554. 4 12 1 0 0 0 0
  3555. 4 18 1 0 0 0 0
  3556. 5 6 1 0 0 0 0
  3557. 5 7 1 0 0 0 0
  3558. 5 8 1 0 0 0 0
  3559. 8 9 1 0 0 0 0
  3560. 8 10 1 0 0 0 0
  3561. 8 11 1 0 0 0 0
  3562. 12 13 1 0 0 0 0
  3563. 12 14 1 0 0 0 0
  3564. 12 15 1 0 0 0 0
  3565. 16 17 1 0 0 0 0
  3566. M END
  3567. $$$$
  3568. dan138.sdf
  3569. MOE2004 3D
  3570. 18 17 0 0 0 0 0 0 0 0999 V2000
  3571. -0.5710 1.3910 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0
  3572. 0.1960 2.0370 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0
  3573. -1.5310 1.8280 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0
  3574. -0.4930 1.4410 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0
  3575. -0.4490 -0.0500 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0
  3576. 0.8580 -0.7270 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
  3577. 0.8910 -1.7490 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0
  3578. 0.8740 -0.8090 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0
  3579. 2.1320 -0.0260 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0
  3580. 3.0090 -0.6100 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0
  3581. 2.1610 0.0860 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0
  3582. 2.2310 0.9650 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3583. -1.6530 -0.8750 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0
  3584. -2.5920 -0.4410 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0
  3585. -1.6120 -1.8920 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0
  3586. -1.6980 -0.9390 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0
  3587. -0.4630 -0.0260 -1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0
  3588. -1.2900 0.3980 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  3589. 1 2 1 0 0 0 0
  3590. 1 3 1 0 0 0 0
  3591. 1 4 1 0 0 0 0
  3592. 1 5 1 0 0 0 0
  3593. 5 6 1 0 0 0 0
  3594. 5 13 1 0 0 0 0
  3595. 5 17 1 0 0 0 0
  3596. 6 7 1 0 0 0 0
  3597. 6 8 1 0 0 0 0
  3598. 6 9 1 0 0 0 0
  3599. 9 10 1 0 0 0 0
  3600. 9 11 1 0 0 0 0
  3601. 9 12 1 0 0 0 0
  3602. 13 14 1 0 0 0 0
  3603. 13 15 1 0 0 0 0
  3604. 13 16 1 0 0 0 0
  3605. 17 18 1 0 0 0 0
  3606. M END
  3607. $$$$
  3608. dan139.sdf
  3609. MOE2004 3D
  3610. 18 17 0 0 0 0 0 0 0 0999 V2000
  3611. 1.9030 -0.0170 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0
  3612. 2.6150 -0.6140 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0
  3613. 1.8780 0.9810 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0
  3614. 0.5240 -0.6750 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0
  3615. 0.6310 -1.7000 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0
  3616. 0.1820 -0.7520 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0
  3617. -0.5400 0.0410 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0
  3618. -0.1930 0.0850 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0
  3619. -0.8040 1.4710 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0
  3620. 0.0820 2.1020 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0
  3621. -1.0990 1.4940 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0
  3622. -1.6080 1.9330 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0
  3623. -1.8450 -0.7590 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0
  3624. -1.6860 -1.7750 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0
  3625. -2.6010 -0.2870 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0
  3626. -2.2550 -0.8330 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0
  3627. 2.3980 0.0980 0.8610 O 0 0 0 0 0 0 0 0 0 0 0 0
  3628. 2.4180 -0.7950 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
  3629. 1 2 1 0 0 0 0
  3630. 1 3 1 0 0 0 0
  3631. 1 4 1 0 0 0 0
  3632. 1 17 1 0 0 0 0
  3633. 4 5 1 0 0 0 0
  3634. 4 6 1 0 0 0 0
  3635. 4 7 1 0 0 0 0
  3636. 7 8 1 0 0 0 0
  3637. 7 9 1 0 0 0 0
  3638. 7 13 1 0 0 0 0
  3639. 9 10 1 0 0 0 0
  3640. 9 11 1 0 0 0 0
  3641. 9 12 1 0 0 0 0
  3642. 13 14 1 0 0 0 0
  3643. 13 15 1 0 0 0 0
  3644. 13 16 1 0 0 0 0
  3645. 17 18 1 0 0 0 0
  3646. M END
  3647. $$$$
  3648. dan140.sdf
  3649. MOE2004 3D
  3650. 18 17 0 0 1 0 0 0 0 0999 V2000
  3651. -1.9810 -0.5380 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0
  3652. -2.0300 -1.2350 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0
  3653. -1.8710 -1.1070 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0
  3654. -2.9490 -0.0250 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0
  3655. -0.8550 0.4760 0.2560 C 0 0 3 0 0 0 0 0 0 0 0 0
  3656. 0.5510 -0.1660 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0
  3657. 0.6240 -0.7140 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3658. 0.8250 -1.1540 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0
  3659. 0.1290 -1.9970 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0
  3660. 0.7410 -0.6750 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0
  3661. 1.8350 -1.5690 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0
  3662. 1.6460 0.9060 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0
  3663. 1.4730 1.6330 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0
  3664. 2.6280 0.4540 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0
  3665. 1.6960 1.4500 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0
  3666. -1.0570 1.1380 -0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0
  3667. -0.4480 1.8950 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0
  3668. -0.9570 1.2280 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0
  3669. 1 2 1 0 0 0 0
  3670. 1 3 1 0 0 0 0
  3671. 1 4 1 0 0 0 0
  3672. 1 5 1 0 0 0 0
  3673. 5 6 1 0 0 0 0
  3674. 5 16 1 0 0 0 0
  3675. 5 18 1 0 0 0 0
  3676. 6 7 1 0 0 0 0
  3677. 6 8 1 0 0 0 0
  3678. 6 12 1 0 0 0 0
  3679. 8 9 1 0 0 0 0
  3680. 8 10 1 0 0 0 0
  3681. 8 11 1 0 0 0 0
  3682. 12 13 1 0 0 0 0
  3683. 12 14 1 0 0 0 0
  3684. 12 15 1 0 0 0 0
  3685. 16 17 1 0 0 0 0
  3686. M END
  3687. $$$$
  3688. dan141.sdf
  3689. MOE2004 3D
  3690. 18 17 0 0 0 0 0 0 0 0999 V2000
  3691. 2.7740 0.4020 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0
  3692. 2.8660 0.4120 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0
  3693. 3.2630 -0.5010 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
  3694. 3.3140 1.2690 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0
  3695. 1.3150 0.4530 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0
  3696. 0.8700 1.3850 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0
  3697. 1.2620 0.4790 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0
  3698. 0.5330 -0.7510 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
  3699. 1.0060 -1.6790 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0
  3700. 0.5730 -0.7470 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0
  3701. -0.9230 -0.7390 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0
  3702. -0.9830 -0.7090 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  3703. -1.4230 -1.6490 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0
  3704. -1.5840 0.4040 0.3880 O 0 0 0 0 0 0 0 0 0 0 0 0
  3705. -2.9490 0.4700 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0
  3706. -3.4940 -0.4160 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0
  3707. -3.4010 1.3560 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  3708. -3.0190 0.5610 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0
  3709. 1 2 1 0 0 0 0
  3710. 1 3 1 0 0 0 0
  3711. 1 4 1 0 0 0 0
  3712. 1 5 1 0 0 0 0
  3713. 5 6 1 0 0 0 0
  3714. 5 7 1 0 0 0 0
  3715. 5 8 1 0 0 0 0
  3716. 8 9 1 0 0 0 0
  3717. 8 10 1 0 0 0 0
  3718. 8 11 1 0 0 0 0
  3719. 11 12 1 0 0 0 0
  3720. 11 13 1 0 0 0 0
  3721. 11 14 1 0 0 0 0
  3722. 14 15 1 0 0 0 0
  3723. 15 16 1 0 0 0 0
  3724. 15 17 1 0 0 0 0
  3725. 15 18 1 0 0 0 0
  3726. M END
  3727. $$$$
  3728. dan142.sdf
  3729. MOE2004 3D
  3730. 18 17 0 0 1 0 0 0 0 0999 V2000
  3731. -2.0840 0.9380 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0
  3732. -2.0680 1.1400 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0
  3733. -3.1300 0.8730 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
  3734. -1.6310 1.7900 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0
  3735. -1.3560 -0.3600 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0
  3736. -1.4040 -0.5190 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0
  3737. -1.8880 -1.1920 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0
  3738. 0.1070 -0.3400 -0.1810 C 0 0 3 0 0 0 0 0 0 0 0 0
  3739. 0.7640 -1.6900 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0
  3740. 0.8250 -1.8800 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3741. 0.2090 -2.5080 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0
  3742. 1.7890 -1.7200 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
  3743. 0.7850 0.7030 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0
  3744. 1.9970 1.1290 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  3745. 2.7370 0.3240 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  3746. 1.8040 1.4830 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0
  3747. 2.4050 1.9590 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0
  3748. 0.1380 -0.1290 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0
  3749. 1 2 1 0 0 0 0
  3750. 1 3 1 0 0 0 0
  3751. 1 4 1 0 0 0 0
  3752. 1 5 1 0 0 0 0
  3753. 5 6 1 0 0 0 0
  3754. 5 7 1 0 0 0 0
  3755. 5 8 1 0 0 0 0
  3756. 8 9 1 0 0 0 0
  3757. 8 13 1 0 0 0 0
  3758. 8 18 1 0 0 0 0
  3759. 9 10 1 0 0 0 0
  3760. 9 11 1 0 0 0 0
  3761. 9 12 1 0 0 0 0
  3762. 13 14 1 0 0 0 0
  3763. 14 15 1 0 0 0 0
  3764. 14 16 1 0 0 0 0
  3765. 14 17 1 0 0 0 0
  3766. M END
  3767. $$$$
  3768. dan143.sdf
  3769. MOE2004 3D
  3770. 18 17 0 0 0 0 0 0 0 0999 V2000
  3771. -0.4330 -1.2540 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0
  3772. -0.2470 -2.1630 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  3773. 0.2960 -1.2470 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0
  3774. -1.4280 -1.3280 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0
  3775. -0.3080 -0.0030 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0
  3776. -0.4280 1.2740 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0
  3777. -0.2370 2.1650 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0
  3778. -1.4230 1.3670 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0
  3779. 0.3000 1.2890 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0
  3780. -1.4320 -0.0170 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0
  3781. -1.3620 -0.9040 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0
  3782. -2.4230 -0.0060 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0
  3783. -1.3570 0.8490 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0
  3784. 0.9170 -0.0180 -0.9250 O 0 0 0 0 0 0 0 0 0 0 0 0
  3785. 2.1390 -0.0040 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  3786. 2.2310 -0.8890 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0
  3787. 2.9630 -0.0200 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0
  3788. 2.2330 0.9080 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
  3789. 1 2 1 0 0 0 0
  3790. 1 3 1 0 0 0 0
  3791. 1 4 1 0 0 0 0
  3792. 1 5 1 0 0 0 0
  3793. 5 6 1 0 0 0 0
  3794. 5 10 1 0 0 0 0
  3795. 5 14 1 0 0 0 0
  3796. 6 7 1 0 0 0 0
  3797. 6 8 1 0 0 0 0
  3798. 6 9 1 0 0 0 0
  3799. 10 11 1 0 0 0 0
  3800. 10 12 1 0 0 0 0
  3801. 10 13 1 0 0 0 0
  3802. 14 15 1 0 0 0 0
  3803. 15 16 1 0 0 0 0
  3804. 15 17 1 0 0 0 0
  3805. 15 18 1 0 0 0 0
  3806. M END
  3807. $$$$
  3808. dan144.sdf
  3809. MOE2004 3D
  3810. 18 17 0 0 0 0 0 0 0 0999 V2000
  3811. 1.9380 -0.4460 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0
  3812. 1.5680 -1.3980 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0
  3813. 1.9030 -0.4870 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0
  3814. 1.1340 0.7380 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0
  3815. 1.6200 1.6660 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0
  3816. 1.1780 0.7540 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0
  3817. -0.3220 0.7500 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0
  3818. -0.3550 0.7530 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  3819. -0.7800 1.6910 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0
  3820. -1.1440 -0.4220 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
  3821. -1.0770 -0.4530 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0
  3822. -0.7470 -1.3700 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0
  3823. -2.6050 -0.3120 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0
  3824. -3.1730 -1.1630 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  3825. -3.0560 0.6030 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0
  3826. -2.7110 -0.3040 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0
  3827. 3.3010 -0.3120 0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0
  3828. 3.3270 -0.2890 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0
  3829. 1 2 1 0 0 0 0
  3830. 1 3 1 0 0 0 0
  3831. 1 4 1 0 0 0 0
  3832. 1 17 1 0 0 0 0
  3833. 4 5 1 0 0 0 0
  3834. 4 6 1 0 0 0 0
  3835. 4 7 1 0 0 0 0
  3836. 7 8 1 0 0 0 0
  3837. 7 9 1 0 0 0 0
  3838. 7 10 1 0 0 0 0
  3839. 10 11 1 0 0 0 0
  3840. 10 12 1 0 0 0 0
  3841. 10 13 1 0 0 0 0
  3842. 13 14 1 0 0 0 0
  3843. 13 15 1 0 0 0 0
  3844. 13 16 1 0 0 0 0
  3845. 17 18 1 0 0 0 0
  3846. M END
  3847. $$$$
  3848. dan145.sdf
  3849. MOE2004 3D
  3850. 18 17 0 0 1 0 0 0 0 0999 V2000
  3851. -2.3990 -0.7670 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0
  3852. -2.4760 -0.8520 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0
  3853. -2.2570 -1.7670 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0
  3854. -3.3590 -0.3760 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
  3855. -1.2650 0.1690 0.3110 C 0 0 3 0 0 0 0 0 0 0 0 0
  3856. 0.0850 -0.3510 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0
  3857. 0.0790 -0.3750 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  3858. 0.2330 -1.3800 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0
  3859. 1.2640 0.5110 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0
  3860. 1.2610 0.5930 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0
  3861. 1.1740 1.5250 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0
  3862. 2.5930 -0.0750 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0
  3863. 3.4200 0.5570 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0
  3864. 2.7430 -1.0760 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0
  3865. 2.6410 -0.1470 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  3866. -1.5470 1.4500 -0.2490 O 0 0 0 0 0 0 0 0 0 0 0 0
  3867. -0.9370 2.0910 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  3868. -1.2530 0.2690 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
  3869. 1 2 1 0 0 0 0
  3870. 1 3 1 0 0 0 0
  3871. 1 4 1 0 0 0 0
  3872. 1 5 1 0 0 0 0
  3873. 5 6 1 0 0 0 0
  3874. 5 16 1 0 0 0 0
  3875. 5 18 1 0 0 0 0
  3876. 6 7 1 0 0 0 0
  3877. 6 8 1 0 0 0 0
  3878. 6 9 1 0 0 0 0
  3879. 9 10 1 0 0 0 0
  3880. 9 11 1 0 0 0 0
  3881. 9 12 1 0 0 0 0
  3882. 12 13 1 0 0 0 0
  3883. 12 14 1 0 0 0 0
  3884. 12 15 1 0 0 0 0
  3885. 16 17 1 0 0 0 0
  3886. M END
  3887. $$$$
  3888. dan146.sdf
  3889. MOE2004 3D
  3890. 18 17 0 0 0 0 0 0 0 0999 V2000
  3891. 1.6580 -0.9920 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
  3892. 1.5450 -1.1480 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0
  3893. 2.7070 -1.1690 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  3894. 1.0730 -1.7450 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  3895. 1.2590 0.4190 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0
  3896. 1.2340 0.5010 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0
  3897. 2.0610 1.0950 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  3898. -0.0670 0.9190 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0
  3899. -0.0790 0.7670 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0
  3900. -1.3430 0.3330 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0
  3901. -2.1860 0.9820 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0
  3902. -1.2840 0.3770 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
  3903. -1.6890 -1.0790 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0
  3904. -2.7140 -1.3220 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0
  3905. -1.6230 -1.1850 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
  3906. -1.0400 -1.8230 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0
  3907. -0.1270 2.3310 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0
  3908. 0.6150 2.7390 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0
  3909. 1 2 1 0 0 0 0
  3910. 1 3 1 0 0 0 0
  3911. 1 4 1 0 0 0 0
  3912. 1 5 1 0 0 0 0
  3913. 5 6 1 0 0 0 0
  3914. 5 7 1 0 0 0 0
  3915. 5 8 1 0 0 0 0
  3916. 8 9 1 0 0 0 0
  3917. 8 10 1 0 0 0 0
  3918. 8 17 1 0 0 0 0
  3919. 10 11 1 0 0 0 0
  3920. 10 12 1 0 0 0 0
  3921. 10 13 1 0 0 0 0
  3922. 13 14 1 0 0 0 0
  3923. 13 15 1 0 0 0 0
  3924. 13 16 1 0 0 0 0
  3925. 17 18 1 0 0 0 0
  3926. M END
  3927. $$$$
  3928. dan147.sdf
  3929. MOE2004 3D
  3930. 19 18 0 0 0 0 0 0 0 0999 V2000
  3931. -2.7000 -0.4800 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0
  3932. -3.3260 -0.8320 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0
  3933. -1.8240 0.4010 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0
  3934. -2.4250 1.1850 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0
  3935. -1.3120 -0.1580 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0
  3936. -0.8320 1.0250 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0
  3937. -1.3930 1.6250 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0
  3938. -0.1790 1.7190 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0
  3939. 0.0060 0.0130 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  3940. -0.6550 -0.5780 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0
  3941. 0.6640 0.5670 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0
  3942. 0.8500 -0.9520 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0
  3943. 1.4040 -1.5940 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0
  3944. 0.2000 -1.6140 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0
  3945. 1.8470 -0.2710 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0
  3946. 2.4560 -1.0200 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
  3947. 1.3370 0.3220 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0
  3948. 2.7180 0.5900 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0
  3949. 3.1630 0.0530 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0
  3950. 1 2 1 0 0 0 0
  3951. 1 3 1 0 0 0 0
  3952. 3 4 1 0 0 0 0
  3953. 3 5 1 0 0 0 0
  3954. 3 6 1 0 0 0 0
  3955. 6 7 1 0 0 0 0
  3956. 6 8 1 0 0 0 0
  3957. 6 9 1 0 0 0 0
  3958. 9 10 1 0 0 0 0
  3959. 9 11 1 0 0 0 0
  3960. 9 12 1 0 0 0 0
  3961. 12 13 1 0 0 0 0
  3962. 12 14 1 0 0 0 0
  3963. 12 15 1 0 0 0 0
  3964. 15 16 1 0 0 0 0
  3965. 15 17 1 0 0 0 0
  3966. 15 18 1 0 0 0 0
  3967. 18 19 1 0 0 0 0
  3968. M END
  3969. $$$$
  3970. dan148.sdf
  3971. MOE2004 3D
  3972. 18 17 0 0 0 0 0 0 0 0999 V2000
  3973. 2.5980 0.9750 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0
  3974. 1.7700 1.6520 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
  3975. 3.4080 1.5640 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0
  3976. 2.9650 0.5130 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0
  3977. 2.0800 -0.2910 0.9890 S 0 0 0 0 0 0 0 0 0 0 0 0
  3978. 0.9400 -1.2550 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0
  3979. 0.6710 -2.1590 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0
  3980. 1.4890 -1.5850 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0
  3981. -0.3360 -0.5190 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0
  3982. -0.8980 -1.1830 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0
  3983. -0.0890 0.3660 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
  3984. -1.2390 -0.1240 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0
  3985. -0.7330 0.5950 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0
  3986. -1.4680 -1.0070 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  3987. -2.5400 0.4950 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0
  3988. -2.3490 1.4020 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0
  3989. -3.0990 -0.2050 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
  3990. -3.1730 0.7670 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0
  3991. 1 2 1 0 0 0 0
  3992. 1 3 1 0 0 0 0
  3993. 1 4 1 0 0 0 0
  3994. 1 5 1 0 0 0 0
  3995. 5 6 1 0 0 0 0
  3996. 6 7 1 0 0 0 0
  3997. 6 8 1 0 0 0 0
  3998. 6 9 1 0 0 0 0
  3999. 9 10 1 0 0 0 0
  4000. 9 11 1 0 0 0 0
  4001. 9 12 1 0 0 0 0
  4002. 12 13 1 0 0 0 0
  4003. 12 14 1 0 0 0 0
  4004. 12 15 1 0 0 0 0
  4005. 15 16 1 0 0 0 0
  4006. 15 17 1 0 0 0 0
  4007. 15 18 1 0 0 0 0
  4008. M END
  4009. $$$$
  4010. dan149.sdf
  4011. MOE2004 3D
  4012. 18 17 0 0 0 0 0 0 0 0999 V2000
  4013. 2.4360 -0.0530 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  4014. 2.3930 0.5710 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  4015. 2.3980 0.5700 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  4016. 3.3980 -0.5730 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  4017. 1.1120 -1.2930 0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0
  4018. -0.4130 -0.2320 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  4019. -0.4740 0.6290 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0
  4020. -0.3930 0.0220 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  4021. -1.4270 1.1680 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0
  4022. 0.3140 1.3880 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
  4023. -1.6110 -1.1960 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0
  4024. -1.6140 -1.8340 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0
  4025. -2.5580 -0.6430 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
  4026. -1.6230 -1.8470 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0
  4027. -0.4650 0.6540 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0
  4028. -0.3730 0.0650 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  4029. 0.3200 1.4150 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0
  4030. -1.4200 1.1900 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0
  4031. 1 2 1 0 0 0 0
  4032. 1 3 1 0 0 0 0
  4033. 1 4 1 0 0 0 0
  4034. 1 5 1 0 0 0 0
  4035. 5 6 1 0 0 0 0
  4036. 6 7 1 0 0 0 0
  4037. 6 11 1 0 0 0 0
  4038. 6 15 1 0 0 0 0
  4039. 7 8 1 0 0 0 0
  4040. 7 9 1 0 0 0 0
  4041. 7 10 1 0 0 0 0
  4042. 11 12 1 0 0 0 0
  4043. 11 13 1 0 0 0 0
  4044. 11 14 1 0 0 0 0
  4045. 15 16 1 0 0 0 0
  4046. 15 17 1 0 0 0 0
  4047. 15 18 1 0 0 0 0
  4048. M END
  4049. $$$$
  4050. dan150.sdf
  4051. MOE2004 3D
  4052. 18 17 0 0 0 0 0 0 0 0999 V2000
  4053. 2.6300 -0.3190 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0
  4054. 3.0790 0.5890 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0
  4055. 2.7500 -0.2950 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0
  4056. 3.1900 -1.1770 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0
  4057. 1.1630 -0.4300 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0
  4058. 1.0810 -0.4790 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0
  4059. 0.7680 -1.3710 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0
  4060. 0.3540 0.7540 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
  4061. 0.3990 0.7720 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0
  4062. 0.8160 1.6870 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0
  4063. -1.1090 0.7490 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0
  4064. -1.5650 1.6900 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  4065. -1.1470 0.7480 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0
  4066. -1.9050 -0.4310 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0
  4067. -1.5310 -1.3810 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  4068. -1.8330 -0.4630 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0
  4069. -3.6590 -0.2920 -0.0720 S 0 0 0 0 0 0 0 0 0 0 0 0
  4070. -3.4820 -0.3510 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0
  4071. 1 2 1 0 0 0 0
  4072. 1 3 1 0 0 0 0
  4073. 1 4 1 0 0 0 0
  4074. 1 5 1 0 0 0 0
  4075. 5 6 1 0 0 0 0
  4076. 5 7 1 0 0 0 0
  4077. 5 8 1 0 0 0 0
  4078. 8 9 1 0 0 0 0
  4079. 8 10 1 0 0 0 0
  4080. 8 11 1 0 0 0 0
  4081. 11 12 1 0 0 0 0
  4082. 11 13 1 0 0 0 0
  4083. 11 14 1 0 0 0 0
  4084. 14 15 1 0 0 0 0
  4085. 14 16 1 0 0 0 0
  4086. 14 17 1 0 0 0 0
  4087. 17 18 1 0 0 0 0
  4088. M END
  4089. $$$$
  4090. dan151.sdf
  4091. MOE2004 2D
  4092. 12 12 0 0 0 0 0 0 0 0999 V2000
  4093. 0.1660 1.3970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4094. 1.2930 0.5550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4095. 1.1270 -0.8420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4096. -0.1660 -1.3970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4097. -1.2930 -0.5550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4098. -1.1270 0.8420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4099. -2.5220 1.8840 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4100. -2.8930 -1.2420 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4101. -0.3710 -3.1260 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4102. 2.5220 -1.8840 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4103. 2.8930 1.2420 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4104. 0.3710 3.1260 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4105. 1 2 2 0 0 0 0
  4106. 1 6 1 0 0 0 0
  4107. 1 12 1 0 0 0 0
  4108. 2 3 1 0 0 0 0
  4109. 2 11 1 0 0 0 0
  4110. 3 4 2 0 0 0 0
  4111. 3 10 1 0 0 0 0
  4112. 4 5 1 0 0 0 0
  4113. 4 9 1 0 0 0 0
  4114. 5 6 2 0 0 0 0
  4115. 5 8 1 0 0 0 0
  4116. 6 7 1 0 0 0 0
  4117. M END
  4118. $$$$
  4119. dan152.sdf
  4120. MOE2004 2D
  4121. 12 12 0 0 0 0 0 0 0 0999 V2000
  4122. -1.1720 0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4123. -1.2320 -0.6420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4124. 0.0600 1.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4125. 1.2320 0.6420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4126. 1.1720 -0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4127. -0.0600 -1.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4128. -2.4190 -1.2610 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  4129. -2.3020 1.4640 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  4130. 0.1170 2.7260 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  4131. 2.4190 1.2620 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  4132. 2.3020 -1.4640 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  4133. -0.1170 -2.7260 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
  4134. 1 2 2 0 0 0 0
  4135. 1 3 1 0 0 0 0
  4136. 1 8 1 0 0 0 0
  4137. 2 6 1 0 0 0 0
  4138. 2 7 1 0 0 0 0
  4139. 3 4 2 0 0 0 0
  4140. 3 9 1 0 0 0 0
  4141. 4 5 1 0 0 0 0
  4142. 4 10 1 0 0 0 0
  4143. 5 6 2 0 0 0 0
  4144. 5 11 1 0 0 0 0
  4145. 6 12 1 0 0 0 0
  4146. M END
  4147. $$$$
  4148. dan153.sdf
  4149. MOE2004 2D
  4150. 12 12 0 0 0 0 0 0 0 0999 V2000
  4151. 0.9760 1.0660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4152. 1.7070 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4153. -0.3860 1.3700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4154. -0.7000 2.4110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4155. -1.3340 0.3410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4156. -0.9150 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4157. 0.4500 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4158. 0.7810 -2.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4159. 1.3870 -0.2660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4160. -3.0020 0.7850 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4161. -2.0300 -2.3110 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4162. 3.0650 -0.6390 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4163. 1 2 1 0 0 0 0
  4164. 1 3 1 0 0 0 0
  4165. 1 9 2 0 0 0 0
  4166. 3 4 1 0 0 0 0
  4167. 3 5 2 0 0 0 0
  4168. 5 6 1 0 0 0 0
  4169. 5 10 1 0 0 0 0
  4170. 6 7 2 0 0 0 0
  4171. 6 11 1 0 0 0 0
  4172. 7 8 1 0 0 0 0
  4173. 7 9 1 0 0 0 0
  4174. 9 12 1 0 0 0 0
  4175. M END
  4176. $$$$
  4177. dan154.sdf
  4178. MOE2004 2D
  4179. 12 12 0 0 0 0 0 0 0 0999 V2000
  4180. 0.0000 -1.3510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4181. 0.0000 -2.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4182. -1.2010 -0.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4183. -1.2080 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4184. -2.1460 1.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4185. 0.0000 1.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4186. 0.0000 2.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4187. 1.2080 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4188. 2.1460 1.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4189. 1.2010 -0.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4190. -2.6930 -1.5020 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4191. 2.6930 -1.5020 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4192. 1 2 1 0 0 0 0
  4193. 1 3 1 0 0 0 0
  4194. 1 10 2 0 0 0 0
  4195. 3 4 2 0 0 0 0
  4196. 3 11 1 0 0 0 0
  4197. 4 5 1 0 0 0 0
  4198. 4 6 1 0 0 0 0
  4199. 6 7 1 0 0 0 0
  4200. 6 8 2 0 0 0 0
  4201. 8 9 1 0 0 0 0
  4202. 8 10 1 0 0 0 0
  4203. 10 12 1 0 0 0 0
  4204. M END
  4205. $$$$
  4206. dan155.sdf
  4207. MOE2004 2D
  4208. 12 12 0 0 0 0 0 0 0 0999 V2000
  4209. -1.1270 0.6990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4210. 0.0860 1.3950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4211. 0.0990 2.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4212. 1.2930 0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4213. 2.2350 1.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4214. 1.2930 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4215. 2.2350 -1.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4216. 0.0860 -1.3950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4217. 0.0990 -2.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4218. -1.1270 -0.6990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4219. -2.5850 1.6230 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4220. -2.5850 -1.6230 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4221. 1 2 1 0 0 0 0
  4222. 1 10 2 0 0 0 0
  4223. 1 11 1 0 0 0 0
  4224. 2 3 1 0 0 0 0
  4225. 2 4 2 0 0 0 0
  4226. 4 5 1 0 0 0 0
  4227. 4 6 1 0 0 0 0
  4228. 6 7 1 0 0 0 0
  4229. 6 8 2 0 0 0 0
  4230. 8 9 1 0 0 0 0
  4231. 8 10 1 0 0 0 0
  4232. 10 12 1 0 0 0 0
  4233. M END
  4234. $$$$
  4235. dan156.sdf
  4236. MOE2004 2D
  4237. 12 12 0 0 0 0 0 0 0 0999 V2000
  4238. -1.3890 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4239. -0.6980 -1.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4240. -1.2370 -2.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4241. 0.6980 -1.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4242. 1.2370 -2.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4243. 1.3890 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4244. 0.6980 1.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4245. 1.2360 2.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4246. -0.6980 1.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4247. -1.2370 2.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4248. -3.1090 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4249. 3.1090 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4250. 1 2 2 0 0 0 0
  4251. 1 9 1 0 0 0 0
  4252. 1 11 1 0 0 0 0
  4253. 2 3 1 0 0 0 0
  4254. 2 4 1 0 0 0 0
  4255. 4 5 1 0 0 0 0
  4256. 4 6 2 0 0 0 0
  4257. 6 7 1 0 0 0 0
  4258. 6 12 1 0 0 0 0
  4259. 7 8 1 0 0 0 0
  4260. 7 9 2 0 0 0 0
  4261. 9 10 1 0 0 0 0
  4262. M END
  4263. $$$$
  4264. dan157.sdf
  4265. MOE2004 2D
  4266. 13 13 0 0 0 0 0 0 0 0999 V2000
  4267. -1.0540 -0.7210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4268. -2.0270 -1.2030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4269. 0.0990 -1.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4270. 0.0180 -2.5900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4271. 1.3580 -0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4272. 2.2510 -1.5200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4273. 1.4580 0.4900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4274. 0.3140 1.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4275. 0.3840 2.3670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4276. -0.9340 0.6700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4277. -2.0420 1.4810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4278. -2.8370 0.9210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4279. 3.0110 1.2310 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4280. 1 2 1 0 0 0 0
  4281. 1 3 1 0 0 0 0
  4282. 1 10 2 0 0 0 0
  4283. 3 4 1 0 0 0 0
  4284. 3 5 2 0 0 0 0
  4285. 5 6 1 0 0 0 0
  4286. 5 7 1 0 0 0 0
  4287. 7 8 2 0 0 0 0
  4288. 7 13 1 0 0 0 0
  4289. 8 9 1 0 0 0 0
  4290. 8 10 1 0 0 0 0
  4291. 10 11 1 0 0 0 0
  4292. 11 12 1 0 0 0 0
  4293. M END
  4294. $$$$
  4295. dan158.sdf
  4296. MOE2004 3D
  4297. 13 13 0 0 0 0 0 0 0 0999 V2000
  4298. 0.4150 1.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4299. 0.6020 2.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4300. 1.5000 0.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4301. 2.5140 0.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4302. 1.2880 -1.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4303. 2.1360 -1.7490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4304. -0.0120 -1.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4305. -0.1670 -2.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4306. -1.1010 -0.7050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4307. -0.8860 0.6770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4308. -1.9610 1.5400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4309. -1.6340 2.4550 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  4310. -2.6930 -1.3670 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4311. 1 2 1 0 0 0 0
  4312. 1 3 1 0 0 0 0
  4313. 1 10 2 0 0 0 0
  4314. 3 4 1 0 0 0 0
  4315. 3 5 2 0 0 0 0
  4316. 5 6 1 0 0 0 0
  4317. 5 7 1 0 0 0 0
  4318. 7 8 1 0 0 0 0
  4319. 7 9 2 0 0 0 0
  4320. 9 10 1 0 0 0 0
  4321. 9 13 1 0 0 0 0
  4322. 10 11 1 0 0 0 0
  4323. 11 12 1 0 0 0 0
  4324. M END
  4325. $$$$
  4326. dan159.sdf
  4327. MOE2004 3D
  4328. 13 13 0 0 0 0 0 0 0 0999 V2000
  4329. -0.4790 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4330. -1.0030 -2.1060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4331. 0.9170 -1.1420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4332. 1.4640 -2.0800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4333. 1.5980 0.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4334. 0.8990 1.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4335. 1.4300 2.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4336. -0.4960 1.2720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4337. -1.0520 2.2050 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  4338. -1.1720 0.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4339. -2.5450 0.0920 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  4340. -2.8800 -0.8210 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  4341. 3.3190 0.0880 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  4342. 1 2 1 0 0 0 0
  4343. 1 3 1 0 0 0 0
  4344. 1 10 2 0 0 0 0
  4345. 3 4 1 0 0 0 0
  4346. 3 5 2 0 0 0 0
  4347. 5 6 1 0 0 0 0
  4348. 5 13 1 0 0 0 0
  4349. 6 7 1 0 0 0 0
  4350. 6 8 2 0 0 0 0
  4351. 8 9 1 0 0 0 0
  4352. 8 10 1 0 0 0 0
  4353. 10 11 1 0 0 0 0
  4354. 11 12 1 0 0 0 0
  4355. M END
  4356. $$$$
  4357. dan160.sdf
  4358. MOE2004 2D
  4359. 13 13 0 0 0 0 0 0 0 0999 V2000
  4360. 1.1270 -0.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4361. 0.4600 -1.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4362. 1.0240 -2.1950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4363. -0.9340 -1.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4364. -1.4620 -2.2390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4365. -1.6500 -0.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4366. -2.7360 -0.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4367. -0.9730 1.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4368. -1.5350 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4369. 0.4220 1.1580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4370. 0.9350 2.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4371. 2.5000 -0.0690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4372. 2.8220 0.8480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4373. 1 2 2 0 0 0 0
  4374. 1 10 1 0 0 0 0
  4375. 1 12 1 0 0 0 0
  4376. 2 3 1 0 0 0 0
  4377. 2 4 1 0 0 0 0
  4378. 4 5 1 0 0 0 0
  4379. 4 6 2 0 0 0 0
  4380. 6 7 1 0 0 0 0
  4381. 6 8 1 0 0 0 0
  4382. 8 9 1 0 0 0 0
  4383. 8 10 2 0 0 0 0
  4384. 10 11 1 0 0 0 0
  4385. 12 13 1 0 0 0 0
  4386. M END
  4387. $$$$
  4388. dan161.sdf
  4389. MOE2004 3D
  4390. 14 14 0 0 0 0 0 0 0 0999 V2000
  4391. -0.8550 0.6990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4392. 0.3520 1.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4393. 0.3720 2.4870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4394. 1.5580 0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4395. 2.5000 1.2380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4396. 1.5580 -0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4397. 2.5010 -1.2380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4398. 0.3520 -1.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4399. 0.3720 -2.4870 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  4400. -0.8550 -0.6990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4401. -2.0540 1.3770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4402. -1.8740 2.3310 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  4403. -2.0540 -1.3770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4404. -1.8740 -2.3310 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  4405. 1 2 1 0 0 0 0
  4406. 1 10 2 0 0 0 0
  4407. 1 11 1 0 0 0 0
  4408. 2 3 1 0 0 0 0
  4409. 2 4 2 0 0 0 0
  4410. 4 5 1 0 0 0 0
  4411. 4 6 1 0 0 0 0
  4412. 6 7 1 0 0 0 0
  4413. 6 8 2 0 0 0 0
  4414. 8 9 1 0 0 0 0
  4415. 8 10 1 0 0 0 0
  4416. 10 13 1 0 0 0 0
  4417. 11 12 1 0 0 0 0
  4418. 13 14 1 0 0 0 0
  4419. M END
  4420. $$$$
  4421. dan162.sdf
  4422. MOE2004 2D
  4423. 14 14 0 0 0 0 0 0 0 0999 V2000
  4424. 1.1980 -0.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4425. 1.2110 0.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4426. 2.1430 1.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4427. 0.0000 1.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4428. 0.0000 2.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4429. -1.2110 0.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4430. -2.1430 1.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4431. -1.1980 -0.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4432. 0.0000 -1.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4433. 0.0000 -2.3500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4434. 2.3660 -1.2820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4435. 3.1130 -0.6600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4436. -2.3660 -1.2820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4437. -3.1130 -0.6610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4438. 1 2 1 0 0 0 0
  4439. 1 9 2 0 0 0 0
  4440. 1 11 1 0 0 0 0
  4441. 2 3 1 0 0 0 0
  4442. 2 4 2 0 0 0 0
  4443. 4 5 1 0 0 0 0
  4444. 4 6 1 0 0 0 0
  4445. 6 7 1 0 0 0 0
  4446. 6 8 2 0 0 0 0
  4447. 8 9 1 0 0 0 0
  4448. 8 13 1 0 0 0 0
  4449. 9 10 1 0 0 0 0
  4450. 11 12 1 0 0 0 0
  4451. 13 14 1 0 0 0 0
  4452. M END
  4453. $$$$
  4454. dan163.sdf
  4455. MOE2004 2D
  4456. 14 14 0 0 0 0 0 0 0 0999 V2000
  4457. -0.6980 -1.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4458. -1.2310 -2.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4459. 0.6980 -1.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4460. 1.2310 -2.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4461. 1.3830 0.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4462. 0.6970 1.3320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4463. 1.2460 2.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4464. -0.6970 1.3320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4465. -1.2460 2.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4466. -1.3830 0.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  4467. -2.7560 0.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4468. -3.0950 -0.7450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4469. 2.7560 0.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  4470. 3.0950 -0.7450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4471. 1 2 1 0 0 0 0
  4472. 1 3 1 0 0 0 0
  4473. 1 10 2 0 0 0 0
  4474. 3 4 1 0 0 0 0
  4475. 3 5 2 0 0 0 0
  4476. 5 6 1 0 0 0 0
  4477. 5 13 1 0 0 0 0
  4478. 6 7 1 0 0 0 0
  4479. 6 8 2 0 0 0 0
  4480. 8 9 1 0 0 0 0
  4481. 8 10 1 0 0 0 0
  4482. 10 11 1 0 0 0 0
  4483. 11 12 1 0 0 0 0
  4484. 13 14 1 0 0 0 0
  4485. M END
  4486. $$$$
  4487. dan164.sdf
  4488. MOE2004 3D
  4489. 17 17 0 0 0 0 0 0 0 0999 V2000
  4490. -1.3820 0.0010 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0
  4491. -1.5700 0.0010 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  4492. -2.3600 0.0010 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0
  4493. -0.6100 1.2580 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0
  4494. -1.1690 2.1480 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0
  4495. -0.5210 1.3000 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0
  4496. 0.7800 1.2850 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0
  4497. 0.7190 1.4040 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0
  4498. 1.3520 2.1280 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0
  4499. 1.5200 0.0000 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
  4500. 0.7800 -1.2850 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0
  4501. 1.3510 -2.1280 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0
  4502. 0.7200 -1.4060 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0
  4503. -0.6110 -1.2580 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0
  4504. -0.5240 -1.3010 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0
  4505. -1.1710 -2.1470 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0
  4506. 2.6950 0.0000 0.3500 O 0 0 0 0 0 0 0 0 0 0 0 0
  4507. 1 2 1 0 0 0 0
  4508. 1 3 1 0 0 0 0
  4509. 1 4 1 0 0 0 0
  4510. 1 14 1 0 0 0 0
  4511. 4 5 1 0 0 0 0
  4512. 4 6 1 0 0 0 0
  4513. 4 7 1 0 0 0 0
  4514. 7 8 1 0 0 0 0
  4515. 7 9 1 0 0 0 0
  4516. 7 10 1 0 0 0 0
  4517. 10 11 1 0 0 0 0
  4518. 10 17 2 0 0 0 0
  4519. 11 12 1 0 0 0 0
  4520. 11 13 1 0 0 0 0
  4521. 11 14 1 0 0 0 0
  4522. 14 15 1 0 0 0 0
  4523. 14 16 1 0 0 0 0
  4524. M END
  4525. $$$$
  4526. dan165.sdf
  4527. MOE2004 3D
  4528. 19 18 0 0 0 0 0 0 0 0999 V2000
  4529. -3.0810 -0.5460 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0
  4530. -4.1560 -0.5840 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0
  4531. -2.9200 -0.0270 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0
  4532. -2.7030 -1.5680 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0
  4533. -2.3890 0.2050 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0
  4534. -3.0180 0.6670 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0
  4535. -0.8970 0.3890 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0
  4536. -0.6760 0.7310 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0
  4537. -0.6160 1.1720 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0
  4538. -0.1190 -0.8660 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
  4539. -0.6590 -1.9330 0.7330 O 0 0 0 0 0 0 0 0 0 0 0 0
  4540. 1.2460 -0.7690 0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0
  4541. 1.9170 0.4680 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0
  4542. 1.6610 1.2180 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0
  4543. 1.6280 0.8240 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
  4544. 3.4100 0.2110 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0
  4545. 3.7170 -0.1660 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0
  4546. 3.6860 -0.5530 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0
  4547. 3.9700 1.1260 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0
  4548. 1 2 1 0 0 0 0
  4549. 1 3 1 0 0 0 0
  4550. 1 4 1 0 0 0 0
  4551. 1 5 1 0 0 0 0
  4552. 5 6 2 0 0 0 0
  4553. 5 7 1 0 0 0 0
  4554. 7 8 1 0 0 0 0
  4555. 7 9 1 0 0 0 0
  4556. 7 10 1 0 0 0 0
  4557. 10 11 2 0 0 0 0
  4558. 10 12 1 0 0 0 0
  4559. 12 13 1 0 0 0 0
  4560. 13 14 1 0 0 0 0
  4561. 13 15 1 0 0 0 0
  4562. 13 16 1 0 0 0 0
  4563. 16 17 1 0 0 0 0
  4564. 16 18 1 0 0 0 0
  4565. 16 19 1 0 0 0 0
  4566. M END
  4567. $$$$
  4568. dan166.sdf
  4569. MOE2004 3D
  4570. 20 19 0 0 0 0 0 0 0 0999 V2000
  4571. -3.1160 -0.8910 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0
  4572. -3.9250 -0.2540 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0
  4573. -3.4830 -1.4650 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0
  4574. -2.8620 -1.5840 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0
  4575. -1.9120 -0.0550 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0
  4576. -1.1090 -0.7120 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0
  4577. -2.1930 0.6470 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0
  4578. -1.4830 0.6740 0.6770 O 0 0 0 0 0 0 0 0 0 0 0 0
  4579. -0.3840 1.4790 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0
  4580. 0.0000 2.1580 1.5790 O 0 0 0 0 0 0 0 0 0 0 0 0
  4581. 0.3830 1.4790 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0
  4582. -0.0010 2.1590 -1.5780 O 0 0 0 0 0 0 0 0 0 0 0 0
  4583. 1.4810 0.6740 -0.6770 O 0 0 0 0 0 0 0 0 0 0 0 0
  4584. 1.9120 -0.0540 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0
  4585. 1.1090 -0.7120 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0
  4586. 2.1930 0.6480 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  4587. 3.1170 -0.8900 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0
  4588. 2.8630 -1.5840 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0
  4589. 3.9260 -0.2530 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0
  4590. 3.4850 -1.4630 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0
  4591. 1 2 1 0 0 0 0
  4592. 1 3 1 0 0 0 0
  4593. 1 4 1 0 0 0 0
  4594. 1 5 1 0 0 0 0
  4595. 5 6 1 0 0 0 0
  4596. 5 7 1 0 0 0 0
  4597. 5 8 1 0 0 0 0
  4598. 8 9 1 0 0 0 0
  4599. 9 10 2 0 0 0 0
  4600. 9 11 1 0 0 0 0
  4601. 11 12 2 0 0 0 0
  4602. 11 13 1 0 0 0 0
  4603. 13 14 1 0 0 0 0
  4604. 14 15 1 0 0 0 0
  4605. 14 16 1 0 0 0 0
  4606. 14 17 1 0 0 0 0
  4607. 17 18 1 0 0 0 0
  4608. 17 19 1 0 0 0 0
  4609. 17 20 1 0 0 0 0
  4610. M END
  4611. $$$$
  4612. dan167.sdf
  4613. MOE2004 3D
  4614. 19 19 0 0 0 0 0 0 0 0999 V2000
  4615. -1.6290 -0.0500 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0
  4616. -1.6530 -0.0510 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0
  4617. -2.6700 -0.0560 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0
  4618. -0.9350 1.2180 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0
  4619. -1.4260 2.0970 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0
  4620. -1.0450 1.2950 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0
  4621. 0.5460 1.2260 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0
  4622. 0.6640 1.3120 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0
  4623. 1.0300 2.1150 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0
  4624. 1.2560 -0.0340 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0
  4625. 1.2840 -0.0390 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
  4626. 0.5610 -1.3000 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0
  4627. 1.0560 -2.1840 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0
  4628. 0.6780 -1.3850 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0
  4629. -0.9210 -1.3100 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0
  4630. -1.0280 -1.3870 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0
  4631. -1.4010 -2.1950 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0
  4632. 2.6030 -0.0410 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0
  4633. 3.0300 0.7690 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0
  4634. 1 2 1 0 0 0 0
  4635. 1 3 1 0 0 0 0
  4636. 1 4 1 0 0 0 0
  4637. 1 15 1 0 0 0 0
  4638. 4 5 1 0 0 0 0
  4639. 4 6 1 0 0 0 0
  4640. 4 7 1 0 0 0 0
  4641. 7 8 1 0 0 0 0
  4642. 7 9 1 0 0 0 0
  4643. 7 10 1 0 0 0 0
  4644. 10 11 1 0 0 0 0
  4645. 10 12 1 0 0 0 0
  4646. 10 18 1 0 0 0 0
  4647. 12 13 1 0 0 0 0
  4648. 12 14 1 0 0 0 0
  4649. 12 15 1 0 0 0 0
  4650. 15 16 1 0 0 0 0
  4651. 15 17 1 0 0 0 0
  4652. 18 19 1 0 0 0 0
  4653. M END
  4654. $$$$
  4655. dan168.sdf
  4656. MOE2004 3D
  4657. 19 18 0 0 0 0 0 0 0 0999 V2000
  4658. 2.0720 0.8030 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  4659. 3.1210 0.4920 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0
  4660. 1.9060 1.3930 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
  4661. 1.8900 1.4090 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  4662. 1.1860 -0.4210 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
  4663. 1.6980 -1.5380 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0
  4664. -0.3440 -0.2240 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  4665. -0.7690 0.5280 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0
  4666. -0.3910 0.0290 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
  4667. -1.8590 0.5880 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0
  4668. -0.3860 1.5540 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0
  4669. -1.0390 -1.5980 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
  4670. -0.7570 -2.1990 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0
  4671. -0.7660 -2.1720 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0
  4672. -2.1300 -1.4960 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  4673. -0.7740 0.5600 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0
  4674. -0.4020 0.0820 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0
  4675. -0.3900 1.5850 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0
  4676. -1.8650 0.6240 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0
  4677. 1 2 1 0 0 0 0
  4678. 1 3 1 0 0 0 0
  4679. 1 4 1 0 0 0 0
  4680. 1 5 1 0 0 0 0
  4681. 5 6 2 0 0 0 0
  4682. 5 7 1 0 0 0 0
  4683. 7 8 1 0 0 0 0
  4684. 7 12 1 0 0 0 0
  4685. 7 16 1 0 0 0 0
  4686. 8 9 1 0 0 0 0
  4687. 8 10 1 0 0 0 0
  4688. 8 11 1 0 0 0 0
  4689. 12 13 1 0 0 0 0
  4690. 12 14 1 0 0 0 0
  4691. 12 15 1 0 0 0 0
  4692. 16 17 1 0 0 0 0
  4693. 16 18 1 0 0 0 0
  4694. 16 19 1 0 0 0 0
  4695. M END
  4696. $$$$
  4697. dan169.sdf
  4698. MOE2004 3D
  4699. 19 18 0 0 0 0 0 0 0 0999 V2000
  4700. -1.7610 0.9730 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0
  4701. -1.1920 1.6240 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0
  4702. -2.5730 0.5190 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0
  4703. -2.2100 1.6070 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0
  4704. -0.8600 -0.1000 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0
  4705. -0.4730 -0.7170 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0
  4706. -1.6370 -0.9810 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0
  4707. -1.0020 -1.7720 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0
  4708. -2.0200 -0.3990 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0
  4709. -2.4870 -1.4590 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
  4710. 0.3280 0.5290 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0
  4711. 0.2630 1.6400 1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0
  4712. 1.6120 -0.2720 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0
  4713. 1.3760 -1.3360 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0
  4714. 2.1620 0.0170 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0
  4715. 2.4550 -0.0180 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0
  4716. 1.9320 -0.3310 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0
  4717. 2.6890 1.0460 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0
  4718. 3.3960 -0.5720 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0
  4719. 1 2 1 0 0 0 0
  4720. 1 3 1 0 0 0 0
  4721. 1 4 1 0 0 0 0
  4722. 1 5 1 0 0 0 0
  4723. 5 6 1 0 0 0 0
  4724. 5 7 1 0 0 0 0
  4725. 5 11 1 0 0 0 0
  4726. 7 8 1 0 0 0 0
  4727. 7 9 1 0 0 0 0
  4728. 7 10 1 0 0 0 0
  4729. 11 12 2 0 0 0 0
  4730. 11 13 1 0 0 0 0
  4731. 13 14 1 0 0 0 0
  4732. 13 15 1 0 0 0 0
  4733. 13 16 1 0 0 0 0
  4734. 16 17 1 0 0 0 0
  4735. 16 18 1 0 0 0 0
  4736. 16 19 1 0 0 0 0
  4737. M END
  4738. $$$$
  4739. dan170.sdf
  4740. MOE2004 3D
  4741. 19 18 0 0 0 0 0 0 0 0999 V2000
  4742. -2.1970 0.7230 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  4743. -2.8070 0.0210 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0
  4744. -2.8740 1.3810 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  4745. -1.6310 1.3440 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0
  4746. -1.2790 -0.0140 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0
  4747. -0.6690 0.7100 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0
  4748. -1.8970 -0.5230 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0
  4749. -0.3870 -1.0580 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0
  4750. 0.2030 -1.5660 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0
  4751. -1.0260 -1.8310 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0
  4752. 0.5510 -0.5300 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0
  4753. 1.1350 -1.3750 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
  4754. -0.0460 -0.1670 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0
  4755. 1.5080 0.5810 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0
  4756. 2.0480 0.9540 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  4757. 0.9790 1.4320 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0
  4758. 2.5270 0.0890 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0
  4759. 2.1310 -0.2440 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
  4760. 3.7310 0.0710 0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0
  4761. 1 2 1 0 0 0 0
  4762. 1 3 1 0 0 0 0
  4763. 1 4 1 0 0 0 0
  4764. 1 5 1 0 0 0 0
  4765. 5 6 1 0 0 0 0
  4766. 5 7 1 0 0 0 0
  4767. 5 8 1 0 0 0 0
  4768. 8 9 1 0 0 0 0
  4769. 8 10 1 0 0 0 0
  4770. 8 11 1 0 0 0 0
  4771. 11 12 1 0 0 0 0
  4772. 11 13 1 0 0 0 0
  4773. 11 14 1 0 0 0 0
  4774. 14 15 1 0 0 0 0
  4775. 14 16 1 0 0 0 0
  4776. 14 17 1 0 0 0 0
  4777. 17 18 1 0 0 0 0
  4778. 17 19 2 0 0 0 0
  4779. M END
  4780. $$$$
  4781. dan171.sdf
  4782. MOE2004 3D
  4783. 19 18 0 0 0 0 0 0 0 0999 V2000
  4784. -2.2990 0.7540 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0
  4785. -3.1720 0.4250 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0
  4786. -1.4910 0.9970 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0
  4787. -2.5800 1.6400 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0
  4788. -1.8620 -0.3450 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0
  4789. -2.2770 -1.4930 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0
  4790. -0.8800 0.0140 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0
  4791. -1.3140 0.8350 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0
  4792. -0.7910 -0.8390 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0
  4793. 0.4950 0.4160 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0
  4794. 0.4020 1.2560 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0
  4795. 1.1000 0.7730 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0
  4796. 1.2220 -0.7430 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
  4797. 1.3210 -1.5850 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0
  4798. 0.6440 -1.1000 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0
  4799. 2.6050 -0.3280 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0
  4800. 3.2280 0.0030 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0
  4801. 2.5410 0.4900 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0
  4802. 3.1080 -1.1700 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0
  4803. 1 2 1 0 0 0 0
  4804. 1 3 1 0 0 0 0
  4805. 1 4 1 0 0 0 0
  4806. 1 5 1 0 0 0 0
  4807. 5 6 2 0 0 0 0
  4808. 5 7 1 0 0 0 0
  4809. 7 8 1 0 0 0 0
  4810. 7 9 1 0 0 0 0
  4811. 7 10 1 0 0 0 0
  4812. 10 11 1 0 0 0 0
  4813. 10 12 1 0 0 0 0
  4814. 10 13 1 0 0 0 0
  4815. 13 14 1 0 0 0 0
  4816. 13 15 1 0 0 0 0
  4817. 13 16 1 0 0 0 0
  4818. 16 17 1 0 0 0 0
  4819. 16 18 1 0 0 0 0
  4820. 16 19 1 0 0 0 0
  4821. M END
  4822. $$$$
  4823. dan172.sdf
  4824. MOE2004 3D
  4825. 19 18 0 0 0 0 0 0 0 0999 V2000
  4826. -2.3550 -0.7840 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0
  4827. -2.8910 -0.2330 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0
  4828. -1.7460 -1.5500 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0
  4829. -3.0920 -1.2940 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0
  4830. -1.5020 0.1490 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0
  4831. -2.1570 0.8190 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
  4832. -0.9100 -0.4100 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
  4833. -0.5770 1.0060 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0
  4834. -0.6440 2.2310 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0
  4835. 0.4400 0.3250 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0
  4836. 0.9620 1.0990 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0
  4837. -0.0990 -0.2870 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0
  4838. 1.4550 -0.5270 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0
  4839. 2.0880 -1.0480 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0
  4840. 0.9490 -1.3020 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0
  4841. 2.3460 0.2970 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0
  4842. 3.0930 -0.3440 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0
  4843. 2.8750 1.0740 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0
  4844. 1.7650 0.7790 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0
  4845. 1 2 1 0 0 0 0
  4846. 1 3 1 0 0 0 0
  4847. 1 4 1 0 0 0 0
  4848. 1 5 1 0 0 0 0
  4849. 5 6 1 0 0 0 0
  4850. 5 7 1 0 0 0 0
  4851. 5 8 1 0 0 0 0
  4852. 8 9 2 0 0 0 0
  4853. 8 10 1 0 0 0 0
  4854. 10 11 1 0 0 0 0
  4855. 10 12 1 0 0 0 0
  4856. 10 13 1 0 0 0 0
  4857. 13 14 1 0 0 0 0
  4858. 13 15 1 0 0 0 0
  4859. 13 16 1 0 0 0 0
  4860. 16 17 1 0 0 0 0
  4861. 16 18 1 0 0 0 0
  4862. 16 19 1 0 0 0 0
  4863. M END
  4864. $$$$
  4865. dan173.sdf
  4866. MOE2004 3D
  4867. 19 18 0 0 0 0 0 0 0 0999 V2000
  4868. -2.2920 0.8730 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0
  4869. -3.3480 0.6450 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
  4870. -1.7510 0.8040 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0
  4871. -2.2230 1.8880 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0
  4872. -1.7230 -0.1090 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0
  4873. -2.3350 -1.1250 -0.6190 O 0 0 0 0 0 0 0 0 0 0 0 0
  4874. -0.3550 0.1950 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0
  4875. -0.3750 1.2270 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0
  4876. -0.2040 -0.4420 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0
  4877. 0.7810 -0.0020 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  4878. 0.5610 0.5700 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  4879. 0.9350 -1.4730 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0
  4880. 0.0300 -1.8510 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0
  4881. 1.1360 -2.1020 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0
  4882. 1.7630 -1.6030 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0
  4883. 2.0960 0.5230 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0
  4884. 2.0160 1.5860 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0
  4885. 2.9120 0.4120 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0
  4886. 2.3770 -0.0160 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0
  4887. 1 2 1 0 0 0 0
  4888. 1 3 1 0 0 0 0
  4889. 1 4 1 0 0 0 0
  4890. 1 5 1 0 0 0 0
  4891. 5 6 2 0 0 0 0
  4892. 5 7 1 0 0 0 0
  4893. 7 8 1 0 0 0 0
  4894. 7 9 1 0 0 0 0
  4895. 7 10 1 0 0 0 0
  4896. 10 11 1 0 0 0 0
  4897. 10 12 1 0 0 0 0
  4898. 10 16 1 0 0 0 0
  4899. 12 13 1 0 0 0 0
  4900. 12 14 1 0 0 0 0
  4901. 12 15 1 0 0 0 0
  4902. 16 17 1 0 0 0 0
  4903. 16 18 1 0 0 0 0
  4904. 16 19 1 0 0 0 0
  4905. M END
  4906. $$$$
  4907. dan174.sdf
  4908. MOE2004 3D
  4909. 19 18 0 0 1 0 0 0 0 0999 V2000
  4910. -2.1760 0.6880 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0
  4911. -2.9290 1.3440 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  4912. -2.6490 -0.2610 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0
  4913. -1.7750 1.1700 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0
  4914. -1.0620 0.4500 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0
  4915. -1.0790 0.9740 -1.4400 O 0 0 0 0 0 0 0 0 0 0 0 0
  4916. 0.0550 -0.4910 0.1090 C 0 0 3 0 0 0 0 0 0 0 0 0
  4917. -0.2840 -1.9010 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0
  4918. -1.2510 -2.2300 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0
  4919. -0.3450 -1.9480 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0
  4920. 0.4730 -2.6200 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0
  4921. 1.4240 -0.0450 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0
  4922. 1.3980 0.0460 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0
  4923. 2.1740 -0.8100 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0
  4924. 1.8880 1.2760 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0
  4925. 1.2140 2.0960 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0
  4926. 1.9460 1.2160 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0
  4927. 2.8840 1.5310 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  4928. 0.0940 -0.4880 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0
  4929. 1 2 1 0 0 0 0
  4930. 1 3 1 0 0 0 0
  4931. 1 4 1 0 0 0 0
  4932. 1 5 1 0 0 0 0
  4933. 5 6 2 0 0 0 0
  4934. 5 7 1 0 0 0 0
  4935. 7 8 1 0 0 0 0
  4936. 7 12 1 0 0 0 0
  4937. 7 19 1 0 0 0 0
  4938. 8 9 1 0 0 0 0
  4939. 8 10 1 0 0 0 0
  4940. 8 11 1 0 0 0 0
  4941. 12 13 1 0 0 0 0
  4942. 12 14 1 0 0 0 0
  4943. 12 15 1 0 0 0 0
  4944. 15 16 1 0 0 0 0
  4945. 15 17 1 0 0 0 0
  4946. 15 18 1 0 0 0 0
  4947. M END
  4948. $$$$
  4949. dan175.sdf
  4950. MOE2004 3D
  4951. 20 19 0 0 0 0 0 0 0 0999 V2000
  4952. -3.1730 0.7120 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0
  4953. -2.7470 1.0490 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0
  4954. -4.2400 0.5310 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0
  4955. -3.0810 1.4770 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  4956. -2.5240 -0.5740 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
  4957. -3.1600 -1.6140 0.2090 O 0 0 0 0 0 0 0 0 0 0 0 0
  4958. -1.1840 -0.5280 0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0
  4959. -0.4240 0.6830 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0
  4960. -0.8190 1.4440 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  4961. -0.4910 1.0430 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0
  4962. 1.0330 0.4030 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0
  4963. 1.0830 0.0090 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0
  4964. 1.5930 1.3440 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0
  4965. 1.6830 -0.6040 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0
  4966. 1.6220 -0.2350 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0
  4967. 1.1460 -1.5580 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0
  4968. 3.1410 -0.8470 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0
  4969. 3.7200 0.0800 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0
  4970. 3.2360 -1.2480 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0
  4971. 3.5860 -1.5680 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0
  4972. 1 2 1 0 0 0 0
  4973. 1 3 1 0 0 0 0
  4974. 1 4 1 0 0 0 0
  4975. 1 5 1 0 0 0 0
  4976. 5 6 2 0 0 0 0
  4977. 5 7 1 0 0 0 0
  4978. 7 8 1 0 0 0 0
  4979. 8 9 1 0 0 0 0
  4980. 8 10 1 0 0 0 0
  4981. 8 11 1 0 0 0 0
  4982. 11 12 1 0 0 0 0
  4983. 11 13 1 0 0 0 0
  4984. 11 14 1 0 0 0 0
  4985. 14 15 1 0 0 0 0
  4986. 14 16 1 0 0 0 0
  4987. 14 17 1 0 0 0 0
  4988. 17 18 1 0 0 0 0
  4989. 17 19 1 0 0 0 0
  4990. 17 20 1 0 0 0 0
  4991. M END
  4992. $$$$
  4993. dan176.sdf
  4994. MOE2004 3D
  4995. 20 19 0 0 1 0 0 0 0 0999 V2000
  4996. 2.8200 -0.6030 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0
  4997. 2.6950 -0.8340 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0
  4998. 3.0570 -1.5320 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  4999. 3.6360 0.1160 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0
  5000. 1.5640 -0.0170 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0
  5001. 1.4470 0.3030 -1.3690 O 0 0 0 0 0 0 0 0 0 0 0 0
  5002. 0.6060 0.0950 0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0
  5003. -0.6970 0.6260 0.4460 C 0 0 3 0 0 0 0 0 0 0 0 0
  5004. -0.6190 2.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  5005. -0.0130 2.6700 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5006. -0.1570 2.1910 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0
  5007. -1.6170 2.5310 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0
  5008. -1.4770 -0.2560 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0
  5009. -0.9950 -0.2600 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0
  5010. -2.4800 0.1600 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0
  5011. -1.6030 -1.6960 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0
  5012. -0.6250 -2.1780 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0
  5013. -2.0930 -1.7430 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0
  5014. -2.2030 -2.2780 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0
  5015. -1.2470 0.6190 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0
  5016. 1 2 1 0 0 0 0
  5017. 1 3 1 0 0 0 0
  5018. 1 4 1 0 0 0 0
  5019. 1 5 1 0 0 0 0
  5020. 5 6 2 0 0 0 0
  5021. 5 7 1 0 0 0 0
  5022. 7 8 1 0 0 0 0
  5023. 8 9 1 0 0 0 0
  5024. 8 13 1 0 0 0 0
  5025. 8 20 1 0 0 0 0
  5026. 9 10 1 0 0 0 0
  5027. 9 11 1 0 0 0 0
  5028. 9 12 1 0 0 0 0
  5029. 13 14 1 0 0 0 0
  5030. 13 15 1 0 0 0 0
  5031. 13 16 1 0 0 0 0
  5032. 16 17 1 0 0 0 0
  5033. 16 18 1 0 0 0 0
  5034. 16 19 1 0 0 0 0
  5035. M END
  5036. $$$$
  5037. dan177.sdf
  5038. MOE2004 3D
  5039. 20 19 0 0 0 0 0 0 0 0999 V2000
  5040. 2.8830 0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  5041. 2.8420 1.4600 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0
  5042. 3.8040 0.2130 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0
  5043. 2.8940 1.3830 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0
  5044. 1.7020 -0.1240 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
  5045. 1.7900 -1.3430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  5046. 0.5490 0.6110 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0
  5047. -0.7470 -0.0390 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  5048. -0.9490 -0.8700 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0
  5049. -0.7160 -0.2770 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  5050. -0.2930 -1.7450 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  5051. -1.9790 -1.2320 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  5052. -0.9520 -0.8830 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0
  5053. -0.7210 -0.3010 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5054. -1.9830 -1.2460 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0
  5055. -0.2980 -1.7590 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0
  5056. -1.7660 1.1080 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  5057. -1.6280 1.7590 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0
  5058. -2.7970 0.7410 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  5059. -1.6340 1.7450 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
  5060. 1 2 1 0 0 0 0
  5061. 1 3 1 0 0 0 0
  5062. 1 4 1 0 0 0 0
  5063. 1 5 1 0 0 0 0
  5064. 5 6 2 0 0 0 0
  5065. 5 7 1 0 0 0 0
  5066. 7 8 1 0 0 0 0
  5067. 8 9 1 0 0 0 0
  5068. 8 13 1 0 0 0 0
  5069. 8 17 1 0 0 0 0
  5070. 9 10 1 0 0 0 0
  5071. 9 11 1 0 0 0 0
  5072. 9 12 1 0 0 0 0
  5073. 13 14 1 0 0 0 0
  5074. 13 15 1 0 0 0 0
  5075. 13 16 1 0 0 0 0
  5076. 17 18 1 0 0 0 0
  5077. 17 19 1 0 0 0 0
  5078. 17 20 1 0 0 0 0
  5079. M END
  5080. $$$$
  5081. dan178.sdf
  5082. MOE2004 3D
  5083. 20 19 0 0 0 0 0 0 0 0999 V2000
  5084. -2.8540 -0.0160 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0
  5085. -3.3940 -0.3150 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
  5086. -2.6550 -0.9120 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0
  5087. -3.5110 0.6340 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0
  5088. -1.5660 0.7170 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  5089. -1.8250 1.6390 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  5090. -1.0640 1.0120 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  5091. -0.6340 -0.1130 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0
  5092. -1.1870 -0.5320 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0
  5093. 0.1400 0.5090 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0
  5094. -0.0050 -1.2690 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0
  5095. -0.5020 -2.3880 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0
  5096. 1.1140 -1.0230 0.7050 O 0 0 0 0 0 0 0 0 0 0 0 0
  5097. 1.8630 0.2050 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0
  5098. 2.3460 0.3050 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0
  5099. 1.2210 1.0810 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
  5100. 2.9250 0.1360 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0
  5101. 3.5320 1.0460 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  5102. 3.5820 -0.7240 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0
  5103. 2.4740 0.0070 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0
  5104. 1 2 1 0 0 0 0
  5105. 1 3 1 0 0 0 0
  5106. 1 4 1 0 0 0 0
  5107. 1 5 1 0 0 0 0
  5108. 5 6 1 0 0 0 0
  5109. 5 7 1 0 0 0 0
  5110. 5 8 1 0 0 0 0
  5111. 8 9 1 0 0 0 0
  5112. 8 10 1 0 0 0 0
  5113. 8 11 1 0 0 0 0
  5114. 11 12 2 0 0 0 0
  5115. 11 13 1 0 0 0 0
  5116. 13 14 1 0 0 0 0
  5117. 14 15 1 0 0 0 0
  5118. 14 16 1 0 0 0 0
  5119. 14 17 1 0 0 0 0
  5120. 17 18 1 0 0 0 0
  5121. 17 19 1 0 0 0 0
  5122. 17 20 1 0 0 0 0
  5123. M END
  5124. $$$$
  5125. dan179.sdf
  5126. MOE2004 3D
  5127. 20 19 0 0 0 0 0 0 0 0999 V2000
  5128. 2.5360 0.2390 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0
  5129. 2.5120 0.4130 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0
  5130. 2.7010 -0.8290 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  5131. 3.3950 0.7780 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0
  5132. 1.2500 0.7190 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0
  5133. 1.1810 1.8050 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0
  5134. 1.3180 0.5420 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0
  5135. -0.0050 0.0460 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
  5136. 0.0040 0.1670 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0
  5137. -1.2820 0.7080 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0
  5138. -1.3680 0.5430 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0
  5139. -1.2240 1.7930 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0
  5140. -2.5470 0.2020 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0
  5141. -2.7020 -0.8660 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0
  5142. -2.5040 0.3640 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0
  5143. -3.4220 0.7350 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0
  5144. -0.0020 -1.4370 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0
  5145. -0.0660 -1.8700 -1.4070 O 0 0 0 0 0 0 0 0 0 0 0 0
  5146. 0.0860 -2.2540 0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0
  5147. 0.1370 -1.7970 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0
  5148. 1 2 1 0 0 0 0
  5149. 1 3 1 0 0 0 0
  5150. 1 4 1 0 0 0 0
  5151. 1 5 1 0 0 0 0
  5152. 5 6 1 0 0 0 0
  5153. 5 7 1 0 0 0 0
  5154. 5 8 1 0 0 0 0
  5155. 8 9 1 0 0 0 0
  5156. 8 10 1 0 0 0 0
  5157. 8 17 1 0 0 0 0
  5158. 10 11 1 0 0 0 0
  5159. 10 12 1 0 0 0 0
  5160. 10 13 1 0 0 0 0
  5161. 13 14 1 0 0 0 0
  5162. 13 15 1 0 0 0 0
  5163. 13 16 1 0 0 0 0
  5164. 17 18 2 0 0 0 0
  5165. 17 19 1 0 0 0 0
  5166. 19 20 1 0 0 0 0
  5167. M END
  5168. $$$$
  5169. dan180.sdf
  5170. MOE2004 3D
  5171. 20 19 0 0 0 0 0 0 0 0999 V2000
  5172. 3.2160 -0.1530 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0
  5173. 3.5370 -1.0340 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0
  5174. 3.8130 0.7060 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0
  5175. 3.4260 -0.3580 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0
  5176. 1.7370 0.1080 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0
  5177. 1.4370 0.9800 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0
  5178. 1.5480 0.2860 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
  5179. 1.0130 -1.0560 0.1940 O 0 0 0 0 0 0 0 0 0 0 0 0
  5180. -0.3530 -1.1350 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0
  5181. -0.9100 -2.1840 0.4850 O 0 0 0 0 0 0 0 0 0 0 0 0
  5182. -1.1380 0.1290 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0
  5183. -0.5680 0.7590 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0
  5184. -2.4270 -0.2420 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0
  5185. -2.2080 -0.8300 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5186. -3.0960 -0.8390 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0
  5187. -2.9710 0.6560 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  5188. -1.4520 0.9020 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0
  5189. -0.5380 1.1720 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0
  5190. -1.9960 1.8250 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  5191. -2.0660 0.3070 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0
  5192. 1 2 1 0 0 0 0
  5193. 1 3 1 0 0 0 0
  5194. 1 4 1 0 0 0 0
  5195. 1 5 1 0 0 0 0
  5196. 5 6 1 0 0 0 0
  5197. 5 7 1 0 0 0 0
  5198. 5 8 1 0 0 0 0
  5199. 8 9 1 0 0 0 0
  5200. 9 10 2 0 0 0 0
  5201. 9 11 1 0 0 0 0
  5202. 11 12 1 0 0 0 0
  5203. 11 13 1 0 0 0 0
  5204. 11 17 1 0 0 0 0
  5205. 13 14 1 0 0 0 0
  5206. 13 15 1 0 0 0 0
  5207. 13 16 1 0 0 0 0
  5208. 17 18 1 0 0 0 0
  5209. 17 19 1 0 0 0 0
  5210. 17 20 1 0 0 0 0
  5211. M END
  5212. $$$$
  5213. dan181.sdf
  5214. MOE2004 3D
  5215. 20 19 0 0 0 0 0 0 0 0999 V2000
  5216. 3.0060 0.3590 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0
  5217. 3.4710 -0.1350 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0
  5218. 3.1300 -0.2870 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5219. 3.5470 1.2910 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  5220. 1.5360 0.6460 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
  5221. 1.4500 1.3170 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5222. 1.1230 1.1740 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0
  5223. 0.7530 -0.6420 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0
  5224. 0.8040 -1.2920 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0
  5225. 1.2300 -1.1910 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0
  5226. -0.7110 -0.3990 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0
  5227. -1.1580 -1.3600 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0
  5228. -0.7670 0.2340 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0
  5229. -1.5300 0.2290 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0
  5230. -1.1920 1.2480 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5231. -1.4320 -0.3340 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
  5232. -2.9900 0.3040 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
  5233. -3.5340 1.3070 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0
  5234. -3.6460 -0.8710 -0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0
  5235. -3.0890 -1.5960 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0
  5236. 1 2 1 0 0 0 0
  5237. 1 3 1 0 0 0 0
  5238. 1 4 1 0 0 0 0
  5239. 1 5 1 0 0 0 0
  5240. 5 6 1 0 0 0 0
  5241. 5 7 1 0 0 0 0
  5242. 5 8 1 0 0 0 0
  5243. 8 9 1 0 0 0 0
  5244. 8 10 1 0 0 0 0
  5245. 8 11 1 0 0 0 0
  5246. 11 12 1 0 0 0 0
  5247. 11 13 1 0 0 0 0
  5248. 11 14 1 0 0 0 0
  5249. 14 15 1 0 0 0 0
  5250. 14 16 1 0 0 0 0
  5251. 14 17 1 0 0 0 0
  5252. 17 18 2 0 0 0 0
  5253. 17 19 1 0 0 0 0
  5254. 19 20 1 0 0 0 0
  5255. M END
  5256. $$$$
  5257. dan182.sdf
  5258. MOE2004 3D
  5259. 20 19 0 0 0 0 0 0 0 0999 V2000
  5260. -2.7800 -1.0440 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0
  5261. -2.4420 -1.7900 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  5262. -3.8630 -1.1580 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
  5263. -2.3290 -1.2050 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5264. -2.4860 0.3480 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0
  5265. -3.3760 1.1630 0.3840 O 0 0 0 0 0 0 0 0 0 0 0 0
  5266. -1.1720 0.6640 0.3910 O 0 0 0 0 0 0 0 0 0 0 0 0
  5267. -0.1160 -0.2810 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0
  5268. -0.1460 -0.6010 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0
  5269. -0.2570 -1.1520 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0
  5270. 1.2330 0.3790 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0
  5271. 1.2080 0.7510 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0
  5272. 2.3670 -0.6370 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0
  5273. 2.2120 -1.4800 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
  5274. 2.4380 -1.0340 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0
  5275. 3.3300 -0.1800 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0
  5276. 1.4920 1.5810 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0
  5277. 0.7220 2.3480 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0
  5278. 2.4570 2.0440 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  5279. 1.5070 1.2850 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0
  5280. 1 2 1 0 0 0 0
  5281. 1 3 1 0 0 0 0
  5282. 1 4 1 0 0 0 0
  5283. 1 5 1 0 0 0 0
  5284. 5 6 2 0 0 0 0
  5285. 5 7 1 0 0 0 0
  5286. 7 8 1 0 0 0 0
  5287. 8 9 1 0 0 0 0
  5288. 8 10 1 0 0 0 0
  5289. 8 11 1 0 0 0 0
  5290. 11 12 1 0 0 0 0
  5291. 11 13 1 0 0 0 0
  5292. 11 17 1 0 0 0 0
  5293. 13 14 1 0 0 0 0
  5294. 13 15 1 0 0 0 0
  5295. 13 16 1 0 0 0 0
  5296. 17 18 1 0 0 0 0
  5297. 17 19 1 0 0 0 0
  5298. 17 20 1 0 0 0 0
  5299. M END
  5300. $$$$
  5301. dan183.sdf
  5302. MOE2004 3D
  5303. 20 19 0 0 0 0 0 0 0 0999 V2000
  5304. -2.8910 0.4720 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0
  5305. -2.8350 0.8180 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0
  5306. -2.6060 1.2980 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
  5307. -3.9350 0.2240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0
  5308. -2.0080 -0.7480 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0
  5309. -2.4150 -1.5800 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0
  5310. -2.0590 -1.0500 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0
  5311. -0.5490 -0.5330 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0
  5312. -0.5060 -0.2370 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
  5313. -0.0310 -1.4950 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0
  5314. 0.1790 0.5080 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0
  5315. 0.1100 0.2130 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0
  5316. -0.3020 1.4860 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0
  5317. 1.6490 0.6490 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
  5318. 2.1040 1.4510 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0
  5319. 1.7390 0.8960 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0
  5320. 2.3320 -0.5830 -0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0
  5321. 3.6540 -0.5770 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  5322. 4.0840 -1.5600 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0
  5323. 4.2860 0.3480 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0
  5324. 1 2 1 0 0 0 0
  5325. 1 3 1 0 0 0 0
  5326. 1 4 1 0 0 0 0
  5327. 1 5 1 0 0 0 0
  5328. 5 6 1 0 0 0 0
  5329. 5 7 1 0 0 0 0
  5330. 5 8 1 0 0 0 0
  5331. 8 9 1 0 0 0 0
  5332. 8 10 1 0 0 0 0
  5333. 8 11 1 0 0 0 0
  5334. 11 12 1 0 0 0 0
  5335. 11 13 1 0 0 0 0
  5336. 11 14 1 0 0 0 0
  5337. 14 15 1 0 0 0 0
  5338. 14 16 1 0 0 0 0
  5339. 14 17 1 0 0 0 0
  5340. 17 18 1 0 0 0 0
  5341. 18 19 1 0 0 0 0
  5342. 18 20 2 0 0 0 0
  5343. M END
  5344. $$$$
  5345. dan184.sdf
  5346. MOE2004 3D
  5347. 20 19 0 0 0 0 0 0 0 0999 V2000
  5348. 2.8900 0.0500 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0
  5349. 3.4080 -0.1830 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0
  5350. 3.5810 -0.1420 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0
  5351. 2.6490 1.1180 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0
  5352. 1.6350 -0.7910 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0
  5353. 1.1580 -0.5700 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0
  5354. 1.9040 -1.8530 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0
  5355. 0.6530 -0.5590 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0
  5356. 1.1110 -0.8630 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0
  5357. 0.3880 0.4950 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0
  5358. -0.5090 -1.3900 0.5890 O 0 0 0 0 0 0 0 0 0 0 0 0
  5359. -1.6280 -1.0200 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0
  5360. -2.5490 -1.8120 -0.2690 O 0 0 0 0 0 0 0 0 0 0 0 0
  5361. -1.7160 0.3990 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0
  5362. -2.3390 0.3780 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0
  5363. -0.7460 0.7710 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0
  5364. -2.3480 1.3160 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0
  5365. -2.4330 2.3330 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0
  5366. -3.3510 0.9700 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0
  5367. -1.7570 1.3530 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0
  5368. 1 2 1 0 0 0 0
  5369. 1 3 1 0 0 0 0
  5370. 1 4 1 0 0 0 0
  5371. 1 5 1 0 0 0 0
  5372. 5 6 1 0 0 0 0
  5373. 5 7 1 0 0 0 0
  5374. 5 8 1 0 0 0 0
  5375. 8 9 1 0 0 0 0
  5376. 8 10 1 0 0 0 0
  5377. 8 11 1 0 0 0 0
  5378. 11 12 1 0 0 0 0
  5379. 12 13 2 0 0 0 0
  5380. 12 14 1 0 0 0 0
  5381. 14 15 1 0 0 0 0
  5382. 14 16 1 0 0 0 0
  5383. 14 17 1 0 0 0 0
  5384. 17 18 1 0 0 0 0
  5385. 17 19 1 0 0 0 0
  5386. 17 20 1 0 0 0 0
  5387. M END
  5388. $$$$
  5389. dan185.sdf
  5390. MOE2004 3D
  5391. 21 20 0 0 0 0 0 0 0 0999 V2000
  5392. -3.2620 0.1030 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0
  5393. -3.7310 -0.0800 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0
  5394. -3.9240 0.7370 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0
  5395. -3.1740 -0.8670 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0
  5396. -1.9040 0.7600 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0
  5397. -1.4170 0.9300 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0
  5398. -2.0430 1.7380 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0
  5399. -1.0770 -0.0140 0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0
  5400. -0.3620 -1.0760 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0
  5401. -0.9990 -1.5870 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0
  5402. -0.1130 -1.8080 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0
  5403. 0.9260 -0.5800 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0
  5404. 0.6870 0.1240 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  5405. 1.4370 -1.4320 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0
  5406. 1.8620 0.1080 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0
  5407. 2.0960 -0.5750 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5408. 1.3720 0.9840 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0
  5409. 3.1570 0.5480 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0
  5410. 3.8090 1.0390 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0
  5411. 3.6980 -0.3090 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0
  5412. 2.9620 1.2550 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0
  5413. 1 2 1 0 0 0 0
  5414. 1 3 1 0 0 0 0
  5415. 1 4 1 0 0 0 0
  5416. 1 5 1 0 0 0 0
  5417. 5 6 1 0 0 0 0
  5418. 5 7 1 0 0 0 0
  5419. 5 8 1 0 0 0 0
  5420. 8 9 1 0 0 0 0
  5421. 9 10 1 0 0 0 0
  5422. 9 11 1 0 0 0 0
  5423. 9 12 1 0 0 0 0
  5424. 12 13 1 0 0 0 0
  5425. 12 14 1 0 0 0 0
  5426. 12 15 1 0 0 0 0
  5427. 15 16 1 0 0 0 0
  5428. 15 17 1 0 0 0 0
  5429. 15 18 1 0 0 0 0
  5430. 18 19 1 0 0 0 0
  5431. 18 20 1 0 0 0 0
  5432. 18 21 1 0 0 0 0
  5433. M END
  5434. $$$$
  5435. dan186.sdf
  5436. MOE2004 3D
  5437. 21 20 0 0 0 0 0 0 0 0999 V2000
  5438. 2.9020 -0.3810 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  5439. 2.9830 -1.0270 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  5440. 3.7430 0.3180 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  5441. 2.9800 -1.0290 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  5442. 1.5800 0.3620 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  5443. 1.5210 0.9920 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0
  5444. 1.5210 0.9890 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  5445. 0.5290 -0.6100 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  5446. -0.8260 -0.1110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  5447. -1.7130 -1.3620 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0
  5448. -1.5110 -1.9930 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0
  5449. -1.5060 -1.9810 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  5450. -2.7790 -1.1100 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  5451. -1.1260 0.6970 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0
  5452. -0.8200 0.1460 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5453. -2.1930 0.9320 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0
  5454. -0.5830 1.6470 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0
  5455. -1.1220 0.7180 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0
  5456. -0.8100 0.1830 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0
  5457. -0.5810 1.6690 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0
  5458. -2.1890 0.9510 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0
  5459. 1 2 1 0 0 0 0
  5460. 1 3 1 0 0 0 0
  5461. 1 4 1 0 0 0 0
  5462. 1 5 1 0 0 0 0
  5463. 5 6 1 0 0 0 0
  5464. 5 7 1 0 0 0 0
  5465. 5 8 1 0 0 0 0
  5466. 8 9 1 0 0 0 0
  5467. 9 10 1 0 0 0 0
  5468. 9 14 1 0 0 0 0
  5469. 9 18 1 0 0 0 0
  5470. 10 11 1 0 0 0 0
  5471. 10 12 1 0 0 0 0
  5472. 10 13 1 0 0 0 0
  5473. 14 15 1 0 0 0 0
  5474. 14 16 1 0 0 0 0
  5475. 14 17 1 0 0 0 0
  5476. 18 19 1 0 0 0 0
  5477. 18 20 1 0 0 0 0
  5478. 18 21 1 0 0 0 0
  5479. M END
  5480. $$$$
  5481. dan187.sdf
  5482. MOE2004 3D
  5483. 21 20 0 0 0 0 0 0 0 0999 V2000
  5484. -1.7410 -1.2310 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0
  5485. -1.8970 -1.8510 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  5486. -1.0330 -1.7720 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0
  5487. -2.6890 -1.1490 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  5488. -1.2000 0.1440 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0
  5489. -1.0070 0.7340 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0
  5490. -2.2070 0.8910 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0
  5491. -3.1540 1.0410 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5492. -1.8100 1.8710 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0
  5493. -2.4050 0.3500 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0
  5494. 0.0000 -0.0030 -0.6020 O 0 0 0 0 0 0 0 0 0 0 0 0
  5495. 1.2000 -0.1460 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0
  5496. 1.0090 -0.7370 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0
  5497. 2.2100 -0.8900 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0
  5498. 3.1560 -1.0390 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0
  5499. 1.8150 -1.8700 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0
  5500. 2.4090 -0.3480 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0
  5501. 1.7370 1.2310 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0
  5502. 1.0300 1.7680 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
  5503. 2.6870 1.1520 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0
  5504. 1.8890 1.8530 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0
  5505. 1 2 1 0 0 0 0
  5506. 1 3 1 0 0 0 0
  5507. 1 4 1 0 0 0 0
  5508. 1 5 1 0 0 0 0
  5509. 5 6 1 0 0 0 0
  5510. 5 7 1 0 0 0 0
  5511. 5 11 1 0 0 0 0
  5512. 7 8 1 0 0 0 0
  5513. 7 9 1 0 0 0 0
  5514. 7 10 1 0 0 0 0
  5515. 11 12 1 0 0 0 0
  5516. 12 13 1 0 0 0 0
  5517. 12 14 1 0 0 0 0
  5518. 12 18 1 0 0 0 0
  5519. 14 15 1 0 0 0 0
  5520. 14 16 1 0 0 0 0
  5521. 14 17 1 0 0 0 0
  5522. 18 19 1 0 0 0 0
  5523. 18 20 1 0 0 0 0
  5524. 18 21 1 0 0 0 0
  5525. M END
  5526. $$$$
  5527. dan188.sdf
  5528. MOE2004 3D
  5529. 21 20 0 0 0 0 0 0 0 0999 V2000
  5530. -2.0340 -1.3920 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0
  5531. -1.9610 -1.4490 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0
  5532. -1.4980 -2.2420 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0
  5533. -3.0890 -1.5010 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0
  5534. -1.4970 -0.0650 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0
  5535. -2.1930 0.7180 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
  5536. -1.5250 -0.0730 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0
  5537. -0.0690 0.2770 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0
  5538. -0.0930 0.2730 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0
  5539. 0.9610 -0.7720 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0
  5540. 0.6680 -1.7630 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0
  5541. 0.9670 -0.8270 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0
  5542. 2.3810 -0.5170 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0
  5543. 3.0220 -1.3690 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0
  5544. 2.4050 -0.3820 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0
  5545. 2.8190 0.3660 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
  5546. 0.3190 1.6970 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0
  5547. 0.3420 1.7660 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0
  5548. 1.3040 1.9880 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
  5549. -0.6100 2.6640 -0.1860 O 0 0 0 0 0 0 0 0 0 0 0 0
  5550. -0.6200 2.6040 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0
  5551. 1 2 1 0 0 0 0
  5552. 1 3 1 0 0 0 0
  5553. 1 4 1 0 0 0 0
  5554. 1 5 1 0 0 0 0
  5555. 5 6 1 0 0 0 0
  5556. 5 7 1 0 0 0 0
  5557. 5 8 1 0 0 0 0
  5558. 8 9 1 0 0 0 0
  5559. 8 10 1 0 0 0 0
  5560. 8 17 1 0 0 0 0
  5561. 10 11 1 0 0 0 0
  5562. 10 12 1 0 0 0 0
  5563. 10 13 1 0 0 0 0
  5564. 13 14 1 0 0 0 0
  5565. 13 15 1 0 0 0 0
  5566. 13 16 1 0 0 0 0
  5567. 17 18 1 0 0 0 0
  5568. 17 19 1 0 0 0 0
  5569. 17 20 1 0 0 0 0
  5570. 20 21 1 0 0 0 0
  5571. M END
  5572. $$$$
  5573. dan189.sdf
  5574. MOE2004 3D
  5575. 21 20 0 0 0 0 0 0 0 0999 V2000
  5576. -2.3480 -1.0460 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0
  5577. -2.7680 -0.7960 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0
  5578. -3.1030 -1.6170 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0
  5579. -1.4860 -1.6980 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0
  5580. -1.9810 0.2150 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0
  5581. -1.6380 -0.0460 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0
  5582. -2.8990 0.8010 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0
  5583. -0.9470 1.0850 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0
  5584. -1.2150 2.1350 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0
  5585. -0.9970 0.9290 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0
  5586. 0.4960 0.9110 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0
  5587. 0.5480 1.1530 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  5588. 1.1120 1.6550 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  5589. 1.0760 -0.4870 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0
  5590. 1.0030 -0.7280 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0
  5591. 0.4920 -1.2280 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0
  5592. 2.5300 -0.6060 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0
  5593. 2.8660 -1.6420 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  5594. 2.6550 -0.3250 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
  5595. 3.3840 0.2040 0.4290 O 0 0 0 0 0 0 0 0 0 0 0 0
  5596. 3.2210 1.1320 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0
  5597. 1 2 1 0 0 0 0
  5598. 1 3 1 0 0 0 0
  5599. 1 4 1 0 0 0 0
  5600. 1 5 1 0 0 0 0
  5601. 5 6 1 0 0 0 0
  5602. 5 7 1 0 0 0 0
  5603. 5 8 1 0 0 0 0
  5604. 8 9 1 0 0 0 0
  5605. 8 10 1 0 0 0 0
  5606. 8 11 1 0 0 0 0
  5607. 11 12 1 0 0 0 0
  5608. 11 13 1 0 0 0 0
  5609. 11 14 1 0 0 0 0
  5610. 14 15 1 0 0 0 0
  5611. 14 16 1 0 0 0 0
  5612. 14 17 1 0 0 0 0
  5613. 17 18 1 0 0 0 0
  5614. 17 19 1 0 0 0 0
  5615. 17 20 1 0 0 0 0
  5616. 20 21 1 0 0 0 0
  5617. M END
  5618. $$$$
  5619. dan190.sdf
  5620. MOE2004 3D
  5621. 21 20 0 0 1 0 0 0 0 0999 V2000
  5622. -2.3110 1.0760 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
  5623. -3.3670 1.0760 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0
  5624. -2.1290 1.9440 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0
  5625. -1.7440 1.1930 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0
  5626. -1.9600 -0.2260 0.3480 C 0 0 3 0 0 0 0 0 0 0 0 0
  5627. -0.5310 -0.2520 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0
  5628. -0.3860 -1.2030 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  5629. -0.4190 0.5450 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0
  5630. 0.5690 -0.1220 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0
  5631. 0.4740 0.8360 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0
  5632. 0.4590 -0.9110 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0
  5633. 1.9590 -0.2110 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0
  5634. 2.0760 -1.1720 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0
  5635. 2.0770 0.5740 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0
  5636. 3.0570 -0.0670 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0
  5637. 2.9900 -0.8580 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0
  5638. 2.9910 0.8990 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0
  5639. 4.0410 -0.1330 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0
  5640. -2.1330 -1.3180 -0.5520 O 0 0 0 0 0 0 0 0 0 0 0 0
  5641. -3.0530 -1.2970 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0
  5642. -2.6570 -0.3750 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0
  5643. 1 2 1 0 0 0 0
  5644. 1 3 1 0 0 0 0
  5645. 1 4 1 0 0 0 0
  5646. 1 5 1 0 0 0 0
  5647. 5 6 1 0 0 0 0
  5648. 5 19 1 0 0 0 0
  5649. 5 21 1 0 0 0 0
  5650. 6 7 1 0 0 0 0
  5651. 6 8 1 0 0 0 0
  5652. 6 9 1 0 0 0 0
  5653. 9 10 1 0 0 0 0
  5654. 9 11 1 0 0 0 0
  5655. 9 12 1 0 0 0 0
  5656. 12 13 1 0 0 0 0
  5657. 12 14 1 0 0 0 0
  5658. 12 15 1 0 0 0 0
  5659. 15 16 1 0 0 0 0
  5660. 15 17 1 0 0 0 0
  5661. 15 18 1 0 0 0 0
  5662. 19 20 1 0 0 0 0
  5663. M END
  5664. $$$$
  5665. dan191.sdf
  5666. MOE2004 3D
  5667. 21 20 0 0 1 0 0 0 0 0999 V2000
  5668. -1.5420 0.9630 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0
  5669. -0.9970 1.8740 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0
  5670. -1.5660 0.8870 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
  5671. -0.8970 -0.2850 0.2810 C 0 0 3 0 0 0 0 0 0 0 0 0
  5672. 0.5590 -0.4860 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0
  5673. 0.5910 -0.5820 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0
  5674. 0.9310 -1.4360 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  5675. 1.5070 0.6330 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0
  5676. 1.4350 0.7800 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0
  5677. 1.2280 1.5790 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0
  5678. 2.9490 0.3180 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  5679. 3.6090 1.1300 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  5680. 3.2870 -0.6020 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0
  5681. 3.0630 0.1950 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0
  5682. -1.7200 -1.5380 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
  5683. -1.7800 -1.7050 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0
  5684. -1.2720 -2.4280 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
  5685. -2.7410 -1.4570 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0
  5686. -2.8810 1.1270 0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0
  5687. -2.8530 1.2020 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0
  5688. -0.9100 -0.1700 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  5689. 1 2 1 0 0 0 0
  5690. 1 3 1 0 0 0 0
  5691. 1 4 1 0 0 0 0
  5692. 1 19 1 0 0 0 0
  5693. 4 5 1 0 0 0 0
  5694. 4 15 1 0 0 0 0
  5695. 4 21 1 0 0 0 0
  5696. 5 6 1 0 0 0 0
  5697. 5 7 1 0 0 0 0
  5698. 5 8 1 0 0 0 0
  5699. 8 9 1 0 0 0 0
  5700. 8 10 1 0 0 0 0
  5701. 8 11 1 0 0 0 0
  5702. 11 12 1 0 0 0 0
  5703. 11 13 1 0 0 0 0
  5704. 11 14 1 0 0 0 0
  5705. 15 16 1 0 0 0 0
  5706. 15 17 1 0 0 0 0
  5707. 15 18 1 0 0 0 0
  5708. 19 20 1 0 0 0 0
  5709. M END
  5710. $$$$
  5711. dan192.sdf
  5712. MOE2004 3D
  5713. 21 20 0 0 1 0 0 0 0 0999 V2000
  5714. -2.6900 -0.6220 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0
  5715. -2.8680 -1.3470 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0
  5716. -2.5700 -1.1650 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0
  5717. -3.5910 -0.0040 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
  5718. -1.4730 0.2430 0.0870 C 0 0 3 0 0 0 0 0 0 0 0 0
  5719. -0.2040 -0.6150 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0
  5720. -0.3630 -1.3620 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0
  5721. -0.0580 -1.1720 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0
  5722. 1.0860 0.1600 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0
  5723. 0.9580 0.6660 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0
  5724. 2.2550 -0.8160 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0
  5725. 2.0460 -1.5600 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5726. 3.1710 -0.2900 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0
  5727. 2.4510 -1.3520 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0
  5728. 1.4290 1.2180 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0
  5729. 0.6720 2.0060 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0
  5730. 1.5070 0.7750 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0
  5731. 2.3840 1.7000 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0
  5732. -1.7260 0.9310 -1.1350 O 0 0 0 0 0 0 0 0 0 0 0 0
  5733. -1.0450 1.6170 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0
  5734. -1.3720 0.9870 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  5735. 1 2 1 0 0 0 0
  5736. 1 3 1 0 0 0 0
  5737. 1 4 1 0 0 0 0
  5738. 1 5 1 0 0 0 0
  5739. 5 6 1 0 0 0 0
  5740. 5 19 1 0 0 0 0
  5741. 5 21 1 0 0 0 0
  5742. 6 7 1 0 0 0 0
  5743. 6 8 1 0 0 0 0
  5744. 6 9 1 0 0 0 0
  5745. 9 10 1 0 0 0 0
  5746. 9 11 1 0 0 0 0
  5747. 9 15 1 0 0 0 0
  5748. 11 12 1 0 0 0 0
  5749. 11 13 1 0 0 0 0
  5750. 11 14 1 0 0 0 0
  5751. 15 16 1 0 0 0 0
  5752. 15 17 1 0 0 0 0
  5753. 15 18 1 0 0 0 0
  5754. 19 20 1 0 0 0 0
  5755. M END
  5756. $$$$
  5757. dan193.sdf
  5758. MOE2004 3D
  5759. 21 20 0 0 0 0 0 0 0 0999 V2000
  5760. -3.0990 -0.3380 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0
  5761. -3.1100 -0.5080 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0
  5762. -4.1190 -0.0940 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0
  5763. -2.8180 -1.2720 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0
  5764. -2.1550 0.7970 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0
  5765. -2.1410 0.9230 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5766. -2.5530 1.7280 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  5767. -0.7290 0.6010 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0
  5768. -0.1670 1.5210 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0
  5769. -0.7490 0.4780 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0
  5770. -0.0050 -0.5880 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0
  5771. -0.5330 -1.5200 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
  5772. -0.0100 -0.4620 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0
  5773. 1.4360 -0.7160 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0
  5774. 1.4650 -0.8010 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0
  5775. 1.8880 -1.6160 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0
  5776. 2.1820 0.4310 -0.3310 O 0 0 0 0 0 0 0 0 0 0 0 0
  5777. 3.5390 0.3630 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0
  5778. 4.0330 -0.5140 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0
  5779. 4.0560 1.2610 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0
  5780. 3.5900 0.3290 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0
  5781. 1 2 1 0 0 0 0
  5782. 1 3 1 0 0 0 0
  5783. 1 4 1 0 0 0 0
  5784. 1 5 1 0 0 0 0
  5785. 5 6 1 0 0 0 0
  5786. 5 7 1 0 0 0 0
  5787. 5 8 1 0 0 0 0
  5788. 8 9 1 0 0 0 0
  5789. 8 10 1 0 0 0 0
  5790. 8 11 1 0 0 0 0
  5791. 11 12 1 0 0 0 0
  5792. 11 13 1 0 0 0 0
  5793. 11 14 1 0 0 0 0
  5794. 14 15 1 0 0 0 0
  5795. 14 16 1 0 0 0 0
  5796. 14 17 1 0 0 0 0
  5797. 17 18 1 0 0 0 0
  5798. 18 19 1 0 0 0 0
  5799. 18 20 1 0 0 0 0
  5800. 18 21 1 0 0 0 0
  5801. M END
  5802. $$$$
  5803. dan194.sdf
  5804. MOE2004 3D
  5805. 22 21 0 0 0 0 0 0 0 0999 V2000
  5806. -3.6330 0.7020 0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0
  5807. -3.4760 1.0450 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5808. -2.9520 -0.5420 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0
  5809. -3.1250 -0.9390 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0
  5810. -3.3960 -1.2380 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  5811. -1.4600 -0.3730 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0
  5812. -0.9940 -1.3630 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
  5813. -1.3190 0.0590 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
  5814. -0.7820 0.5310 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0
  5815. -1.2950 1.5000 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0
  5816. -0.8900 0.0930 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0
  5817. 0.7000 0.7900 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0
  5818. 1.0640 1.5270 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  5819. 0.8030 1.2500 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0
  5820. 1.5690 -0.4690 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0
  5821. 1.2880 -1.1590 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0
  5822. 1.3920 -0.9790 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0
  5823. 3.0560 -0.1510 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
  5824. 3.6540 -1.0630 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  5825. 3.3750 0.5480 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
  5826. 3.3460 0.4330 0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0
  5827. 3.0750 -0.2020 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0
  5828. 1 2 1 0 0 0 0
  5829. 1 3 1 0 0 0 0
  5830. 3 4 1 0 0 0 0
  5831. 3 5 1 0 0 0 0
  5832. 3 6 1 0 0 0 0
  5833. 6 7 1 0 0 0 0
  5834. 6 8 1 0 0 0 0
  5835. 6 9 1 0 0 0 0
  5836. 9 10 1 0 0 0 0
  5837. 9 11 1 0 0 0 0
  5838. 9 12 1 0 0 0 0
  5839. 12 13 1 0 0 0 0
  5840. 12 14 1 0 0 0 0
  5841. 12 15 1 0 0 0 0
  5842. 15 16 1 0 0 0 0
  5843. 15 17 1 0 0 0 0
  5844. 15 18 1 0 0 0 0
  5845. 18 19 1 0 0 0 0
  5846. 18 20 1 0 0 0 0
  5847. 18 21 1 0 0 0 0
  5848. 21 22 1 0 0 0 0
  5849. M END
  5850. $$$$
  5851. dan195.sdf
  5852. MOE2004 3D
  5853. 22 21 0 0 1 0 0 0 0 0999 V2000
  5854. 1.4750 -0.8110 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0
  5855. 2.3880 -1.4090 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0
  5856. 1.6100 -0.1020 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0
  5857. 0.6800 -1.5100 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0
  5858. 1.1580 -0.0920 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0
  5859. -0.1740 0.6980 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0
  5860. -0.1110 1.6180 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0
  5861. -0.3050 1.0430 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
  5862. -1.4310 -0.0550 -0.5010 C 0 0 3 0 0 0 0 0 0 0 0 0
  5863. -2.7000 0.5300 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  5864. -2.7080 0.4020 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0
  5865. -2.7990 1.5950 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0
  5866. -3.5850 0.0100 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
  5867. 2.3160 0.8420 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0
  5868. 2.1510 1.3120 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
  5869. 2.4450 1.6320 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0
  5870. 3.2570 0.2880 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5871. 1.0730 -1.0840 -1.1490 O 0 0 0 0 0 0 0 0 0 0 0 0
  5872. 0.2830 -1.6230 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0
  5873. -1.3290 -1.4450 -0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0
  5874. -2.1970 -1.8520 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0
  5875. -1.4940 0.0120 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0
  5876. 1 2 1 0 0 0 0
  5877. 1 3 1 0 0 0 0
  5878. 1 4 1 0 0 0 0
  5879. 1 5 1 0 0 0 0
  5880. 5 6 1 0 0 0 0
  5881. 5 14 1 0 0 0 0
  5882. 5 18 1 0 0 0 0
  5883. 6 7 1 0 0 0 0
  5884. 6 8 1 0 0 0 0
  5885. 6 9 1 0 0 0 0
  5886. 9 10 1 0 0 0 0
  5887. 9 20 1 0 0 0 0
  5888. 9 22 1 0 0 0 0
  5889. 10 11 1 0 0 0 0
  5890. 10 12 1 0 0 0 0
  5891. 10 13 1 0 0 0 0
  5892. 14 15 1 0 0 0 0
  5893. 14 16 1 0 0 0 0
  5894. 14 17 1 0 0 0 0
  5895. 18 19 1 0 0 0 0
  5896. 20 21 1 0 0 0 0
  5897. M END
  5898. $$$$
  5899. dan196.sdf
  5900. MOE2004 3D
  5901. 21 20 0 0 0 0 0 0 0 0999 V2000
  5902. -2.9590 0.1150 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0
  5903. -3.5390 0.8330 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0
  5904. -3.6530 -0.6360 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0
  5905. -2.5250 0.6380 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0
  5906. -1.8920 -0.5560 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0
  5907. -1.3220 -1.2630 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0
  5908. -2.3960 -1.1600 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
  5909. -0.9560 0.4220 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0
  5910. -0.2610 -0.1250 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0
  5911. -1.5470 1.0590 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0
  5912. 0.0000 1.5420 0.0520 S 0 0 0 0 0 0 0 0 0 0 0 0
  5913. 0.9530 0.3460 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
  5914. 0.2550 -0.2460 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0
  5915. 1.5420 0.9340 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0
  5916. 1.8910 -0.5780 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
  5917. 1.3230 -1.2360 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0
  5918. 2.3900 -1.2370 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0
  5919. 2.9630 0.1520 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0
  5920. 2.5340 0.7340 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0
  5921. 3.5370 0.8290 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0
  5922. 3.6610 -0.5680 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0
  5923. 1 2 1 0 0 0 0
  5924. 1 3 1 0 0 0 0
  5925. 1 4 1 0 0 0 0
  5926. 1 5 1 0 0 0 0
  5927. 5 6 1 0 0 0 0
  5928. 5 7 1 0 0 0 0
  5929. 5 8 1 0 0 0 0
  5930. 8 9 1 0 0 0 0
  5931. 8 10 1 0 0 0 0
  5932. 8 11 1 0 0 0 0
  5933. 11 12 1 0 0 0 0
  5934. 12 13 1 0 0 0 0
  5935. 12 14 1 0 0 0 0
  5936. 12 15 1 0 0 0 0
  5937. 15 16 1 0 0 0 0
  5938. 15 17 1 0 0 0 0
  5939. 15 18 1 0 0 0 0
  5940. 18 19 1 0 0 0 0
  5941. 18 20 1 0 0 0 0
  5942. 18 21 1 0 0 0 0
  5943. M END
  5944. $$$$
  5945. dan197.sdf
  5946. MOE2004 3D
  5947. 21 20 0 0 0 0 0 0 0 0999 V2000
  5948. 3.2260 0.3360 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  5949. 3.4150 0.9470 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  5950. 3.9640 -0.4720 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  5951. 3.4010 0.9500 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  5952. 1.8220 -0.2470 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
  5953. 1.6880 -0.8680 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  5954. 1.7010 -0.8670 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0
  5955. 0.5980 1.1080 0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0
  5956. -1.0110 0.1810 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  5957. -2.1220 1.2430 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0
  5958. -2.0660 1.8520 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0
  5959. -2.0800 1.9170 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0
  5960. -3.1130 0.7740 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  5961. -1.1320 -0.7280 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0
  5962. -0.9810 -0.1730 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0
  5963. -2.1290 -1.1800 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
  5964. -0.4170 -1.5570 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  5965. -1.1540 -0.6400 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
  5966. -1.0330 -0.0180 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
  5967. -0.4290 -1.4580 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0
  5968. -2.1470 -1.0990 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0
  5969. 1 2 1 0 0 0 0
  5970. 1 3 1 0 0 0 0
  5971. 1 4 1 0 0 0 0
  5972. 1 5 1 0 0 0 0
  5973. 5 6 1 0 0 0 0
  5974. 5 7 1 0 0 0 0
  5975. 5 8 1 0 0 0 0
  5976. 8 9 1 0 0 0 0
  5977. 9 10 1 0 0 0 0
  5978. 9 14 1 0 0 0 0
  5979. 9 18 1 0 0 0 0
  5980. 10 11 1 0 0 0 0
  5981. 10 12 1 0 0 0 0
  5982. 10 13 1 0 0 0 0
  5983. 14 15 1 0 0 0 0
  5984. 14 16 1 0 0 0 0
  5985. 14 17 1 0 0 0 0
  5986. 18 19 1 0 0 0 0
  5987. 18 20 1 0 0 0 0
  5988. 18 21 1 0 0 0 0
  5989. M END
  5990. $$$$
  5991. dan198.sdf
  5992. MOE2004 3D
  5993. 21 20 0 0 0 0 0 0 0 0999 V2000
  5994. -2.6090 -0.3620 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0
  5995. -3.1280 0.2910 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0
  5996. -3.3560 -0.7830 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0
  5997. -2.1650 -1.1920 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0
  5998. -1.5600 0.4090 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0
  5999. -1.0450 -0.2710 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0
  6000. -2.0700 1.1480 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  6001. -0.5490 1.1450 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  6002. 0.1220 1.7260 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0
  6003. -1.0850 1.8810 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0
  6004. 0.2830 0.2590 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0
  6005. 0.9570 0.9030 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6006. -0.3790 -0.2000 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0
  6007. 1.0910 -0.8550 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0
  6008. 1.6380 -1.4090 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0
  6009. 0.3980 -1.5800 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  6010. 2.0710 -0.4080 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0
  6011. 2.5480 -1.2900 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0
  6012. 1.5490 0.1090 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0
  6013. 3.3910 0.6750 -0.1200 S 0 0 0 0 0 0 0 0 0 0 0 0
  6014. 3.9020 -0.1960 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0
  6015. 1 2 1 0 0 0 0
  6016. 1 3 1 0 0 0 0
  6017. 1 4 1 0 0 0 0
  6018. 1 5 1 0 0 0 0
  6019. 5 6 1 0 0 0 0
  6020. 5 7 1 0 0 0 0
  6021. 5 8 1 0 0 0 0
  6022. 8 9 1 0 0 0 0
  6023. 8 10 1 0 0 0 0
  6024. 8 11 1 0 0 0 0
  6025. 11 12 1 0 0 0 0
  6026. 11 13 1 0 0 0 0
  6027. 11 14 1 0 0 0 0
  6028. 14 15 1 0 0 0 0
  6029. 14 16 1 0 0 0 0
  6030. 14 17 1 0 0 0 0
  6031. 17 18 1 0 0 0 0
  6032. 17 19 1 0 0 0 0
  6033. 17 20 1 0 0 0 0
  6034. 20 21 1 0 0 0 0
  6035. M END
  6036. $$$$
  6037. dan199.sdf
  6038. MOE2004 3D
  6039. 22 21 0 0 0 0 0 0 0 0999 V2000
  6040. -3.6700 0.8210 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0
  6041. -4.1560 0.7660 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0
  6042. -3.1020 1.7550 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0
  6043. -4.4540 0.8700 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0
  6044. -2.7840 -0.3940 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0
  6045. -3.4260 -1.2800 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0
  6046. -2.3140 -0.3150 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0
  6047. -1.7340 -0.6240 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0
  6048. -2.2350 -0.7420 1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0
  6049. -1.1990 -1.5610 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0
  6050. -0.5050 0.7170 0.8880 S 0 0 0 0 0 0 0 0 0 0 0 0
  6051. 0.5090 0.6900 -0.9080 S 0 0 0 0 0 0 0 0 0 0 0 0
  6052. 1.7350 -0.6470 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0
  6053. 2.2340 -0.7950 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0
  6054. 1.2010 -1.5780 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0
  6055. 2.7890 -0.3850 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0
  6056. 3.4390 -1.2660 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0
  6057. 2.3230 -0.2890 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0
  6058. 3.6640 0.8310 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0
  6059. 4.4650 0.8910 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0
  6060. 4.1280 0.7700 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0
  6061. 3.0930 1.7630 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0
  6062. 1 2 1 0 0 0 0
  6063. 1 3 1 0 0 0 0
  6064. 1 4 1 0 0 0 0
  6065. 1 5 1 0 0 0 0
  6066. 5 6 1 0 0 0 0
  6067. 5 7 1 0 0 0 0
  6068. 5 8 1 0 0 0 0
  6069. 8 9 1 0 0 0 0
  6070. 8 10 1 0 0 0 0
  6071. 8 11 1 0 0 0 0
  6072. 11 12 1 0 0 0 0
  6073. 12 13 1 0 0 0 0
  6074. 13 14 1 0 0 0 0
  6075. 13 15 1 0 0 0 0
  6076. 13 16 1 0 0 0 0
  6077. 16 17 1 0 0 0 0
  6078. 16 18 1 0 0 0 0
  6079. 16 19 1 0 0 0 0
  6080. 19 20 1 0 0 0 0
  6081. 19 21 1 0 0 0 0
  6082. 19 22 1 0 0 0 0
  6083. M END
  6084. $$$$
  6085. dan200.sdf
  6086. MOE2004 3D
  6087. 15 15 0 0 0 0 0 0 0 0999 V2000
  6088. 0.0680 -1.2260 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6089. -0.4050 -2.2040 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6090. 1.4650 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6091. 2.0220 -2.1350 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6092. 2.1460 0.0090 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6093. 3.2320 0.0240 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6094. 1.4330 1.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6095. 1.9620 2.1490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6096. 0.0380 1.1800 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6097. -0.4830 2.1360 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6098. -0.6900 -0.0340 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6099. -2.2190 -0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6100. -2.9840 -1.6100 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  6101. -2.7920 0.8590 1.4600 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  6102. -2.7940 0.8590 -1.4590 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  6103. 1 2 1 0 0 0 0
  6104. 1 3 1 0 0 0 0
  6105. 1 11 2 0 0 0 0
  6106. 3 4 1 0 0 0 0
  6107. 3 5 2 0 0 0 0
  6108. 5 6 1 0 0 0 0
  6109. 5 7 1 0 0 0 0
  6110. 7 8 1 0 0 0 0
  6111. 7 9 2 0 0 0 0
  6112. 9 10 1 0 0 0 0
  6113. 9 11 1 0 0 0 0
  6114. 11 12 1 0 0 0 0
  6115. 12 13 1 0 0 0 0
  6116. 12 14 1 0 0 0 0
  6117. 12 15 1 0 0 0 0
  6118. M END
  6119. $$$$
  6120. dan201.sdf
  6121. MOE2004 3D
  6122. 15 15 0 0 0 0 0 0 0 0999 V2000
  6123. -0.6810 0.1380 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6124. -0.1580 -1.1690 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
  6125. -0.8230 -2.0300 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  6126. 1.2200 -1.3880 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  6127. 1.6080 -2.4020 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  6128. 2.0980 -0.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6129. 3.1710 -0.4790 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6130. 1.6000 0.9920 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6131. 2.2860 1.8340 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  6132. 0.2220 1.2150 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6133. -0.1380 2.2410 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6134. -2.1680 0.4010 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6135. -2.3740 1.4760 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  6136. -2.9300 -0.2630 1.4620 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  6137. -2.9330 -0.2570 -1.4610 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  6138. 1 2 2 0 0 0 0
  6139. 1 10 1 0 0 0 0
  6140. 1 12 1 0 0 0 0
  6141. 2 3 1 0 0 0 0
  6142. 2 4 1 0 0 0 0
  6143. 4 5 1 0 0 0 0
  6144. 4 6 2 0 0 0 0
  6145. 6 7 1 0 0 0 0
  6146. 6 8 1 0 0 0 0
  6147. 8 9 1 0 0 0 0
  6148. 8 10 2 0 0 0 0
  6149. 10 11 1 0 0 0 0
  6150. 12 13 1 0 0 0 0
  6151. 12 14 1 0 0 0 0
  6152. 12 15 1 0 0 0 0
  6153. M END
  6154. $$$$
  6155. dan202.sdf
  6156. MOE2004 3D
  6157. 15 15 0 0 0 0 0 0 0 0999 V2000
  6158. -0.0310 1.2920 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0
  6159. -0.5690 2.2210 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0
  6160. 1.3630 1.2870 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0
  6161. 1.9070 2.2080 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0
  6162. 2.0610 0.1020 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  6163. 3.1470 0.1010 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0
  6164. 1.3670 -1.0800 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0
  6165. 1.9160 -1.9970 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0
  6166. -0.0280 -1.0820 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0
  6167. -0.5510 -2.0040 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0
  6168. -0.7230 0.1040 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  6169. -2.1790 0.1400 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0
  6170. -2.8150 1.0290 0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0
  6171. -2.7430 -0.8820 -0.5720 O 0 0 0 0 0 0 0 0 0 0 0 0
  6172. -2.1230 -1.4400 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
  6173. 1 2 1 0 0 0 0
  6174. 1 3 1 0 0 0 0
  6175. 1 11 2 0 0 0 0
  6176. 3 4 1 0 0 0 0
  6177. 3 5 2 0 0 0 0
  6178. 5 6 1 0 0 0 0
  6179. 5 7 1 0 0 0 0
  6180. 7 8 1 0 0 0 0
  6181. 7 9 2 0 0 0 0
  6182. 9 10 1 0 0 0 0
  6183. 9 11 1 0 0 0 0
  6184. 11 12 1 0 0 0 0
  6185. 12 13 2 0 0 0 0
  6186. 12 14 1 0 0 0 0
  6187. 14 15 1 0 0 0 0
  6188. M END
  6189. $$$$
  6190. dan203.sdf
  6191. MOE2004 3D
  6192. 15 15 0 0 0 0 0 0 0 0999 V2000
  6193. -1.0810 -1.0430 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6194. -1.7190 -1.9220 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6195. 0.3060 -1.2020 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6196. 0.7240 -2.2050 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6197. 1.1310 -0.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6198. 0.5840 1.2100 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6199. 1.2260 2.0870 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6200. -0.8020 1.3690 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6201. -1.2400 2.3620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6202. -1.6220 0.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6203. -2.9800 0.4470 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  6204. -3.4240 -0.4170 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6205. 2.5840 -0.2550 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  6206. 2.9560 -1.2940 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
  6207. 3.3580 0.6940 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  6208. 1 2 1 0 0 0 0
  6209. 1 3 1 0 0 0 0
  6210. 1 10 2 0 0 0 0
  6211. 3 4 1 0 0 0 0
  6212. 3 5 2 0 0 0 0
  6213. 5 6 1 0 0 0 0
  6214. 5 13 1 0 0 0 0
  6215. 6 7 1 0 0 0 0
  6216. 6 8 2 0 0 0 0
  6217. 8 9 1 0 0 0 0
  6218. 8 10 1 0 0 0 0
  6219. 10 11 1 0 0 0 0
  6220. 11 12 1 0 0 0 0
  6221. 13 14 1 0 0 0 0
  6222. 13 15 2 0 0 0 0
  6223. M END
  6224. $$$$
  6225. dan204.sdf
  6226. MOE2004 3D
  6227. 15 15 0 0 0 0 0 0 0 0999 V2000
  6228. 0.7740 -0.4320 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6229. -0.2380 -1.4020 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6230. -0.0020 -2.4630 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6231. -1.5790 -1.0160 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6232. -2.3620 -1.7690 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6233. -1.9160 0.3360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  6234. -2.9610 0.6340 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  6235. -0.9150 1.3070 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6236. -1.2010 2.3550 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6237. 0.4300 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6238. 2.1580 -0.9200 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6239. 2.2760 -2.0170 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
  6240. 3.1530 -0.2070 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0
  6241. 1.4000 1.8980 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0
  6242. 0.9820 2.7740 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6243. 1 2 1 0 0 0 0
  6244. 1 10 2 0 0 0 0
  6245. 1 11 1 0 0 0 0
  6246. 2 3 1 0 0 0 0
  6247. 2 4 2 0 0 0 0
  6248. 4 5 1 0 0 0 0
  6249. 4 6 1 0 0 0 0
  6250. 6 7 1 0 0 0 0
  6251. 6 8 2 0 0 0 0
  6252. 8 9 1 0 0 0 0
  6253. 8 10 1 0 0 0 0
  6254. 10 14 1 0 0 0 0
  6255. 11 12 1 0 0 0 0
  6256. 11 13 2 0 0 0 0
  6257. 14 15 1 0 0 0 0
  6258. M END
  6259. $$$$
  6260. dan205.sdf
  6261. MOE2004 3D
  6262. 15 15 0 0 0 0 0 0 0 0999 V2000
  6263. -0.0170 -1.2080 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0
  6264. 0.4990 -2.1590 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0
  6265. -1.3780 -1.2060 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0
  6266. -1.9070 -2.1460 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0
  6267. -2.0580 0.0000 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0
  6268. -3.1180 0.0010 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0
  6269. -1.3770 1.2060 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0
  6270. -1.9070 2.1470 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0
  6271. -0.0160 1.2080 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0
  6272. 0.5000 2.1580 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0
  6273. 0.6790 0.0000 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0
  6274. 2.1470 0.0000 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0
  6275. 2.4240 -0.8830 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0
  6276. 2.4240 0.8820 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0
  6277. 3.1060 0.0010 0.9660 Cl 0 0 0 0 0 0 0 0 0 0 0 0
  6278. 1 2 1 0 0 0 0
  6279. 1 3 1 0 0 0 0
  6280. 1 11 2 0 0 0 0
  6281. 3 4 1 0 0 0 0
  6282. 3 5 2 0 0 0 0
  6283. 5 6 1 0 0 0 0
  6284. 5 7 1 0 0 0 0
  6285. 7 8 1 0 0 0 0
  6286. 7 9 2 0 0 0 0
  6287. 9 10 1 0 0 0 0
  6288. 9 11 1 0 0 0 0
  6289. 11 12 1 0 0 0 0
  6290. 12 13 1 0 0 0 0
  6291. 12 14 1 0 0 0 0
  6292. 12 15 1 0 0 0 0
  6293. M END
  6294. $$$$
  6295. dan206.sdf
  6296. MOE2004 3D
  6297. 16 16 0 0 0 0 0 0 0 0999 V2000
  6298. 0.5550 -0.0030 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0
  6299. -0.1470 -1.2090 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0
  6300. 0.3730 -2.1600 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0
  6301. -1.5200 -1.2040 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0
  6302. -2.0560 -2.1420 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0
  6303. -2.2030 0.0050 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0
  6304. -3.2720 0.0070 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0
  6305. -1.5140 1.2090 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0
  6306. -2.0470 2.1510 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0
  6307. -0.1420 1.2070 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0
  6308. 0.3830 2.1550 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0
  6309. 2.0420 -0.0060 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0
  6310. 2.3470 0.8680 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0
  6311. 2.3460 -0.8930 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0
  6312. 2.7530 0.0070 -0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0
  6313. 2.1020 0.0060 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0
  6314. 1 2 2 0 0 0 0
  6315. 1 10 1 0 0 0 0
  6316. 1 12 1 0 0 0 0
  6317. 2 3 1 0 0 0 0
  6318. 2 4 1 0 0 0 0
  6319. 4 5 1 0 0 0 0
  6320. 4 6 2 0 0 0 0
  6321. 6 7 1 0 0 0 0
  6322. 6 8 1 0 0 0 0
  6323. 8 9 1 0 0 0 0
  6324. 8 10 2 0 0 0 0
  6325. 10 11 1 0 0 0 0
  6326. 12 13 1 0 0 0 0
  6327. 12 14 1 0 0 0 0
  6328. 12 15 1 0 0 0 0
  6329. 15 16 1 0 0 0 0
  6330. M END
  6331. $$$$
  6332. dan207.sdf
  6333. MOE2004 3D
  6334. 16 16 0 0 0 0 0 0 0 0999 V2000
  6335. 1.5990 1.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6336. 2.5490 1.5540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6337. 0.4120 1.7610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6338. 0.4440 2.8470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6339. -0.8180 1.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6340. -1.7350 1.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6341. -0.8780 -0.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6342. 0.3170 -1.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6343. 0.3050 -2.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6344. 1.5390 -0.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6345. -2.2090 -0.9950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6346. -2.0950 -2.0830 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
  6347. -2.7820 -0.7140 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  6348. -2.7780 -0.7220 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  6349. 2.6820 -1.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  6350. 3.4490 -0.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6351. 1 2 1 0 0 0 0
  6352. 1 3 1 0 0 0 0
  6353. 1 10 2 0 0 0 0
  6354. 3 4 1 0 0 0 0
  6355. 3 5 2 0 0 0 0
  6356. 5 6 1 0 0 0 0
  6357. 5 7 1 0 0 0 0
  6358. 7 8 2 0 0 0 0
  6359. 7 11 1 0 0 0 0
  6360. 8 9 1 0 0 0 0
  6361. 8 10 1 0 0 0 0
  6362. 10 15 1 0 0 0 0
  6363. 11 12 1 0 0 0 0
  6364. 11 13 1 0 0 0 0
  6365. 11 14 1 0 0 0 0
  6366. 15 16 1 0 0 0 0
  6367. M END
  6368. $$$$
  6369. dan208.sdf
  6370. MOE2004 3D
  6371. 16 16 0 0 0 0 0 0 0 0999 V2000
  6372. 0.8400 1.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6373. 0.9510 2.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6374. 1.9820 0.7160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6375. 2.9660 1.1750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6376. 1.8620 -0.6720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6377. 2.7520 -1.2940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6378. 0.5990 -1.2660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6379. 0.5240 -2.3510 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6380. -0.5630 -0.4800 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6381. -0.4220 0.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6382. -1.5530 1.7000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  6383. -1.2840 2.6340 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6384. -1.9040 -1.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6385. -2.7360 -0.4510 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0
  6386. -2.0100 -1.7810 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  6387. -2.0030 -1.7950 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0
  6388. 1 2 1 0 0 0 0
  6389. 1 3 1 0 0 0 0
  6390. 1 10 2 0 0 0 0
  6391. 3 4 1 0 0 0 0
  6392. 3 5 2 0 0 0 0
  6393. 5 6 1 0 0 0 0
  6394. 5 7 1 0 0 0 0
  6395. 7 8 1 0 0 0 0
  6396. 7 9 2 0 0 0 0
  6397. 9 10 1 0 0 0 0
  6398. 9 13 1 0 0 0 0
  6399. 10 11 1 0 0 0 0
  6400. 11 12 1 0 0 0 0
  6401. 13 14 1 0 0 0 0
  6402. 13 15 1 0 0 0 0
  6403. 13 16 1 0 0 0 0
  6404. M END
  6405. $$$$
  6406. dan209.sdf
  6407. MOE2004 3D
  6408. 16 16 0 0 0 0 0 0 0 0999 V2000
  6409. -1.1210 1.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6410. -1.6410 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6411. 0.2740 1.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6412. 0.8180 2.0910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6413. 0.9720 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6414. 0.2500 -1.2690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6415. 0.7690 -2.2240 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6416. -1.1450 -1.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6417. -1.7030 -2.1850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6418. -1.8190 -0.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6419. 2.4740 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6420. 2.8770 -1.0850 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  6421. 2.8520 0.4320 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0
  6422. 2.8530 0.4530 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  6423. -3.1920 -0.0690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  6424. -3.5190 0.8460 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6425. 1 2 1 0 0 0 0
  6426. 1 3 1 0 0 0 0
  6427. 1 10 2 0 0 0 0
  6428. 3 4 1 0 0 0 0
  6429. 3 5 2 0 0 0 0
  6430. 5 6 1 0 0 0 0
  6431. 5 11 1 0 0 0 0
  6432. 6 7 1 0 0 0 0
  6433. 6 8 2 0 0 0 0
  6434. 8 9 1 0 0 0 0
  6435. 8 10 1 0 0 0 0
  6436. 10 15 1 0 0 0 0
  6437. 11 12 1 0 0 0 0
  6438. 11 13 1 0 0 0 0
  6439. 11 14 1 0 0 0 0
  6440. 15 16 1 0 0 0 0
  6441. M END
  6442. $$$$
  6443. dan210.sdf
  6444. MOE2004 3D
  6445. 23 22 0 0 0 0 0 0 0 0999 V2000
  6446. -3.9980 1.3220 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  6447. -3.8560 1.6010 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0
  6448. -5.0700 1.2840 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0
  6449. -3.5470 2.1150 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0
  6450. -3.3400 -0.0120 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0
  6451. -3.4770 -0.2690 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  6452. -3.7890 -0.7910 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0
  6453. -1.9430 0.1020 -0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0
  6454. -1.2200 -1.0330 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0
  6455. -1.6750 -2.1000 0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0
  6456. 0.2310 -0.7990 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0
  6457. 0.2980 -0.2290 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0
  6458. 0.6930 -1.7800 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  6459. 0.9350 -0.0750 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0
  6460. 0.3730 0.2580 2.0020 O 0 0 0 0 0 0 0 0 0 0 0 0
  6461. 2.2630 0.2010 0.7760 O 0 0 0 0 0 0 0 0 0 0 0 0
  6462. 2.9600 -0.1820 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0
  6463. 2.5130 0.3180 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0
  6464. 2.9150 -1.2680 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0
  6465. 4.4070 0.2490 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0
  6466. 4.9830 -0.0180 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0
  6467. 4.4750 1.3310 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0
  6468. 4.8680 -0.2250 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0
  6469. 1 2 1 0 0 0 0
  6470. 1 3 1 0 0 0 0
  6471. 1 4 1 0 0 0 0
  6472. 1 5 1 0 0 0 0
  6473. 5 6 1 0 0 0 0
  6474. 5 7 1 0 0 0 0
  6475. 5 8 1 0 0 0 0
  6476. 8 9 1 0 0 0 0
  6477. 9 10 2 0 0 0 0
  6478. 9 11 1 0 0 0 0
  6479. 11 12 1 0 0 0 0
  6480. 11 13 1 0 0 0 0
  6481. 11 14 1 0 0 0 0
  6482. 14 15 2 0 0 0 0
  6483. 14 16 1 0 0 0 0
  6484. 16 17 1 0 0 0 0
  6485. 17 18 1 0 0 0 0
  6486. 17 19 1 0 0 0 0
  6487. 17 20 1 0 0 0 0
  6488. 20 21 1 0 0 0 0
  6489. 20 22 1 0 0 0 0
  6490. 20 23 1 0 0 0 0
  6491. M END
  6492. $$$$
  6493. dan211.sdf
  6494. MOE2004 3D
  6495. 22 21 0 0 0 0 0 0 0 0999 V2000
  6496. 1.8340 1.2630 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0
  6497. 1.5050 2.1770 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0
  6498. 2.9200 1.3180 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0
  6499. 1.3830 1.2570 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0
  6500. 1.4480 0.0270 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0
  6501. 1.9980 0.0640 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0
  6502. 1.8340 -1.2670 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0
  6503. 2.9190 -1.3260 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0
  6504. 1.5160 -2.1400 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  6505. 1.3730 -1.3430 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0
  6506. -0.0350 0.0390 0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0
  6507. -0.3860 0.0770 2.0910 O 0 0 0 0 0 0 0 0 0 0 0 0
  6508. -1.0660 0.0000 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0
  6509. -0.5520 -0.0070 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  6510. -1.9460 1.2450 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0
  6511. -2.6660 1.2580 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0
  6512. -2.5070 1.2950 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0
  6513. -1.3390 2.1550 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0
  6514. -1.8980 -1.2750 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0
  6515. -2.6180 -1.3430 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0
  6516. -1.2590 -2.1630 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  6517. -2.4570 -1.3120 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0
  6518. 1 2 1 0 0 0 0
  6519. 1 3 1 0 0 0 0
  6520. 1 4 1 0 0 0 0
  6521. 1 5 1 0 0 0 0
  6522. 5 6 1 0 0 0 0
  6523. 5 7 1 0 0 0 0
  6524. 5 11 1 0 0 0 0
  6525. 7 8 1 0 0 0 0
  6526. 7 9 1 0 0 0 0
  6527. 7 10 1 0 0 0 0
  6528. 11 12 2 0 0 0 0
  6529. 11 13 1 0 0 0 0
  6530. 13 14 1 0 0 0 0
  6531. 13 15 1 0 0 0 0
  6532. 13 19 1 0 0 0 0
  6533. 15 16 1 0 0 0 0
  6534. 15 17 1 0 0 0 0
  6535. 15 18 1 0 0 0 0
  6536. 19 20 1 0 0 0 0
  6537. 19 21 1 0 0 0 0
  6538. 19 22 1 0 0 0 0
  6539. M END
  6540. $$$$
  6541. dan212.sdf
  6542. MOE2004 3D
  6543. 22 21 0 0 0 0 0 0 0 0999 V2000
  6544. -2.7400 -0.5030 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0
  6545. -3.2920 0.1050 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0
  6546. -2.2810 -1.3410 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
  6547. -3.4600 -0.9190 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0
  6548. -1.6990 0.3290 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0
  6549. -2.2200 1.0790 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0
  6550. -1.1520 -0.3070 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0
  6551. -0.7270 1.0550 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0
  6552. -1.2950 1.7480 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0
  6553. -0.0630 1.6830 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0
  6554. 0.1150 0.1540 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0
  6555. -0.5440 -0.3480 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0
  6556. 0.7690 0.7910 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0
  6557. 0.9600 -0.9140 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0
  6558. 0.2960 -1.6400 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0
  6559. 1.5120 -1.4720 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0
  6560. 1.9470 -0.3860 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0
  6561. 1.4550 0.2260 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
  6562. 2.4100 -1.2330 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
  6563. 3.0470 0.4260 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0
  6564. 2.7350 1.3650 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
  6565. 4.2270 0.1010 0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0
  6566. 1 2 1 0 0 0 0
  6567. 1 3 1 0 0 0 0
  6568. 1 4 1 0 0 0 0
  6569. 1 5 1 0 0 0 0
  6570. 5 6 1 0 0 0 0
  6571. 5 7 1 0 0 0 0
  6572. 5 8 1 0 0 0 0
  6573. 8 9 1 0 0 0 0
  6574. 8 10 1 0 0 0 0
  6575. 8 11 1 0 0 0 0
  6576. 11 12 1 0 0 0 0
  6577. 11 13 1 0 0 0 0
  6578. 11 14 1 0 0 0 0
  6579. 14 15 1 0 0 0 0
  6580. 14 16 1 0 0 0 0
  6581. 14 17 1 0 0 0 0
  6582. 17 18 1 0 0 0 0
  6583. 17 19 1 0 0 0 0
  6584. 17 20 1 0 0 0 0
  6585. 20 21 1 0 0 0 0
  6586. 20 22 2 0 0 0 0
  6587. M END
  6588. $$$$
  6589. dan213.sdf
  6590. MOE2004 3D
  6591. 22 21 0 0 0 0 0 0 0 0999 V2000
  6592. -3.1400 1.1450 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0
  6593. -4.2330 1.1560 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0
  6594. -2.7850 1.4280 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0
  6595. -2.7850 1.8610 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0
  6596. -2.6470 -0.2360 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0
  6597. -1.1680 -0.4000 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0
  6598. -0.8710 0.3510 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
  6599. -1.0170 -1.3830 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0
  6600. -0.3500 -0.2830 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0
  6601. -0.7970 -0.9200 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0
  6602. -0.4050 0.7420 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0
  6603. 1.1160 -0.6860 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0
  6604. 1.1730 -1.7230 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0
  6605. 1.5970 -0.6620 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0
  6606. 1.8870 0.2250 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0
  6607. 1.7890 1.2690 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
  6608. 1.4710 0.1550 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0
  6609. 3.3610 -0.1430 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0
  6610. 3.8910 0.5160 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  6611. 3.8290 -0.0430 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0
  6612. 3.4970 -1.1740 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0
  6613. -3.4130 -1.1950 -0.2700 O 0 0 0 0 0 0 0 0 0 0 0 0
  6614. 1 2 1 0 0 0 0
  6615. 1 3 1 0 0 0 0
  6616. 1 4 1 0 0 0 0
  6617. 1 5 1 0 0 0 0
  6618. 5 6 1 0 0 0 0
  6619. 5 22 2 0 0 0 0
  6620. 6 7 1 0 0 0 0
  6621. 6 8 1 0 0 0 0
  6622. 6 9 1 0 0 0 0
  6623. 9 10 1 0 0 0 0
  6624. 9 11 1 0 0 0 0
  6625. 9 12 1 0 0 0 0
  6626. 12 13 1 0 0 0 0
  6627. 12 14 1 0 0 0 0
  6628. 12 15 1 0 0 0 0
  6629. 15 16 1 0 0 0 0
  6630. 15 17 1 0 0 0 0
  6631. 15 18 1 0 0 0 0
  6632. 18 19 1 0 0 0 0
  6633. 18 20 1 0 0 0 0
  6634. 18 21 1 0 0 0 0
  6635. M END
  6636. $$$$
  6637. dan214.sdf
  6638. MOE2004 3D
  6639. 22 21 0 0 0 0 0 0 0 0999 V2000
  6640. -2.9620 -0.1520 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0
  6641. -3.4510 -0.8790 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0
  6642. -2.4900 -0.6960 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  6643. -3.7380 0.4920 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0
  6644. -1.9490 0.6840 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0
  6645. -2.4800 1.2590 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
  6646. -1.4920 1.4120 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0
  6647. -0.8790 -0.1670 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0
  6648. -1.3530 -0.8900 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0
  6649. -0.2380 0.4610 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0
  6650. 0.0010 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  6651. 0.8750 -0.1560 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0
  6652. 1.3470 -0.8720 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0
  6653. 0.2310 0.4760 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0
  6654. 1.9470 0.6880 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0
  6655. 2.4720 1.2740 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0
  6656. 1.4920 1.4080 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0
  6657. 2.9660 -0.1540 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0
  6658. 3.7440 0.4860 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  6659. 3.4500 -0.8750 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0
  6660. 2.5000 -0.7060 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0
  6661. 0.0050 -2.1610 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0
  6662. 1 2 1 0 0 0 0
  6663. 1 3 1 0 0 0 0
  6664. 1 4 1 0 0 0 0
  6665. 1 5 1 0 0 0 0
  6666. 5 6 1 0 0 0 0
  6667. 5 7 1 0 0 0 0
  6668. 5 8 1 0 0 0 0
  6669. 8 9 1 0 0 0 0
  6670. 8 10 1 0 0 0 0
  6671. 8 11 1 0 0 0 0
  6672. 11 12 1 0 0 0 0
  6673. 11 22 2 0 0 0 0
  6674. 12 13 1 0 0 0 0
  6675. 12 14 1 0 0 0 0
  6676. 12 15 1 0 0 0 0
  6677. 15 16 1 0 0 0 0
  6678. 15 17 1 0 0 0 0
  6679. 15 18 1 0 0 0 0
  6680. 18 19 1 0 0 0 0
  6681. 18 20 1 0 0 0 0
  6682. 18 21 1 0 0 0 0
  6683. M END
  6684. $$$$
  6685. dan215.sdf
  6686. MOE2004 3D
  6687. 22 22 0 0 0 0 0 0 0 0999 V2000
  6688. -1.0570 0.0300 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0
  6689. -0.2630 1.2970 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0
  6690. -0.8050 2.1920 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0
  6691. -0.2020 1.3870 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0
  6692. 1.1500 1.3050 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  6693. 1.1080 1.3980 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0
  6694. 1.6900 2.1860 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
  6695. 1.9210 0.0440 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0
  6696. 2.8990 0.0470 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  6697. 2.1110 0.0460 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  6698. 1.1610 -1.2260 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0
  6699. 1.7090 -2.1010 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0
  6700. 1.1180 -1.3210 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0
  6701. -0.2520 -1.2300 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0
  6702. -0.1910 -1.3150 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0
  6703. -0.7850 -2.1300 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0
  6704. -1.4790 0.0300 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0
  6705. -2.1070 0.9000 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0
  6706. -2.0880 -0.8510 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0
  6707. -0.6280 0.0400 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0
  6708. -2.2550 0.0410 -0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0
  6709. -2.7530 -0.7700 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0
  6710. 1 2 1 0 0 0 0
  6711. 1 14 1 0 0 0 0
  6712. 1 17 1 0 0 0 0
  6713. 1 21 1 0 0 0 0
  6714. 2 3 1 0 0 0 0
  6715. 2 4 1 0 0 0 0
  6716. 2 5 1 0 0 0 0
  6717. 5 6 1 0 0 0 0
  6718. 5 7 1 0 0 0 0
  6719. 5 8 1 0 0 0 0
  6720. 8 9 1 0 0 0 0
  6721. 8 10 1 0 0 0 0
  6722. 8 11 1 0 0 0 0
  6723. 11 12 1 0 0 0 0
  6724. 11 13 1 0 0 0 0
  6725. 11 14 1 0 0 0 0
  6726. 14 15 1 0 0 0 0
  6727. 14 16 1 0 0 0 0
  6728. 17 18 1 0 0 0 0
  6729. 17 19 1 0 0 0 0
  6730. 17 20 1 0 0 0 0
  6731. 21 22 1 0 0 0 0
  6732. M END
  6733. $$$$
  6734. dan216.sdf
  6735. MOE2004 3D
  6736. 22 21 0 0 0 0 0 0 0 0999 V2000
  6737. 2.9390 -0.4130 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0
  6738. 4.0120 -0.2310 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  6739. 2.7680 -1.4930 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0
  6740. 2.4080 0.0820 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0
  6741. 2.4680 0.1310 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
  6742. 1.0720 -0.2450 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0
  6743. 0.9720 0.0390 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0
  6744. 0.9800 -1.3350 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0
  6745. 0.0060 0.4530 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0
  6746. 0.2600 1.5170 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0
  6747. 0.0320 0.0570 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0
  6748. -1.4160 0.3160 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
  6749. -1.4220 0.7160 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0
  6750. -2.3980 1.1450 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0
  6751. -2.1070 2.2000 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  6752. -2.4390 0.7960 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0
  6753. -3.4090 1.0860 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0
  6754. -1.8830 -1.1400 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0
  6755. -1.2660 -1.7310 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  6756. -2.9150 -1.2040 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0
  6757. -1.8430 -1.6100 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0
  6758. 3.1820 0.8640 0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0
  6759. 1 2 1 0 0 0 0
  6760. 1 3 1 0 0 0 0
  6761. 1 4 1 0 0 0 0
  6762. 1 5 1 0 0 0 0
  6763. 5 6 1 0 0 0 0
  6764. 5 22 2 0 0 0 0
  6765. 6 7 1 0 0 0 0
  6766. 6 8 1 0 0 0 0
  6767. 6 9 1 0 0 0 0
  6768. 9 10 1 0 0 0 0
  6769. 9 11 1 0 0 0 0
  6770. 9 12 1 0 0 0 0
  6771. 12 13 1 0 0 0 0
  6772. 12 14 1 0 0 0 0
  6773. 12 18 1 0 0 0 0
  6774. 14 15 1 0 0 0 0
  6775. 14 16 1 0 0 0 0
  6776. 14 17 1 0 0 0 0
  6777. 18 19 1 0 0 0 0
  6778. 18 20 1 0 0 0 0
  6779. 18 21 1 0 0 0 0
  6780. M END
  6781. $$$$
  6782. dan217.sdf
  6783. MOE2004 3D
  6784. 23 22 0 0 0 0 0 0 0 0999 V2000
  6785. 3.5200 0.5370 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0
  6786. 4.2170 -0.2600 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  6787. 3.4620 1.2480 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0
  6788. 3.9350 1.0610 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0
  6789. 2.1480 -0.0280 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0
  6790. 2.2380 -0.7140 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
  6791. 1.4930 0.7910 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0
  6792. 1.5390 -0.7610 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0
  6793. 1.4320 -0.0540 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0
  6794. 2.2160 -1.5560 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0
  6795. 0.1770 -1.3680 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0
  6796. -0.1860 -1.9190 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0
  6797. 0.2580 -2.0560 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0
  6798. -0.7450 -0.3160 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0
  6799. -2.0230 -0.7320 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0
  6800. -2.4070 -1.8940 0.2280 O 0 0 0 0 0 0 0 0 0 0 0 0
  6801. -2.9090 0.4410 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0
  6802. -2.5470 0.8960 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  6803. -3.9160 0.0590 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0
  6804. -2.9650 1.4600 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0
  6805. -1.9850 1.9190 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6806. -3.2800 0.9920 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0
  6807. -3.6730 2.2570 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
  6808. 1 2 1 0 0 0 0
  6809. 1 3 1 0 0 0 0
  6810. 1 4 1 0 0 0 0
  6811. 1 5 1 0 0 0 0
  6812. 5 6 1 0 0 0 0
  6813. 5 7 1 0 0 0 0
  6814. 5 8 1 0 0 0 0
  6815. 8 9 1 0 0 0 0
  6816. 8 10 1 0 0 0 0
  6817. 8 11 1 0 0 0 0
  6818. 11 12 1 0 0 0 0
  6819. 11 13 1 0 0 0 0
  6820. 11 14 1 0 0 0 0
  6821. 14 15 1 0 0 0 0
  6822. 15 16 2 0 0 0 0
  6823. 15 17 1 0 0 0 0
  6824. 17 18 1 0 0 0 0
  6825. 17 19 1 0 0 0 0
  6826. 17 20 1 0 0 0 0
  6827. 20 21 1 0 0 0 0
  6828. 20 22 1 0 0 0 0
  6829. 20 23 1 0 0 0 0
  6830. M END
  6831. $$$$
  6832. dan218.sdf
  6833. MOE2004 3D
  6834. 23 22 0 0 0 0 0 0 0 0999 V2000
  6835. -1.2220 1.3290 -0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0
  6836. -0.7120 0.8380 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0
  6837. -2.0390 1.9270 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0
  6838. -0.5180 2.0210 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  6839. -1.7550 0.3170 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0
  6840. -2.2500 0.8870 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0
  6841. -2.8240 -0.5700 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0
  6842. -3.6790 0.0320 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0
  6843. -2.4440 -1.0990 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0
  6844. -3.1950 -1.3140 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0
  6845. -0.6320 -0.4960 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0
  6846. 0.0110 0.1680 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0
  6847. -1.0620 -1.1750 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0
  6848. 0.1680 -1.3660 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
  6849. -0.2950 -2.4050 -0.4270 O 0 0 0 0 0 0 0 0 0 0 0 0
  6850. 1.4110 -0.9410 -0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0
  6851. 2.1220 0.1030 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0
  6852. 2.1990 -0.1360 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0
  6853. 1.6070 1.0580 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
  6854. 3.5120 0.1930 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0
  6855. 4.0990 0.9750 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  6856. 4.0390 -0.7610 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0
  6857. 3.4570 0.4130 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0
  6858. 1 2 1 0 0 0 0
  6859. 1 3 1 0 0 0 0
  6860. 1 4 1 0 0 0 0
  6861. 1 5 1 0 0 0 0
  6862. 5 6 1 0 0 0 0
  6863. 5 7 1 0 0 0 0
  6864. 5 11 1 0 0 0 0
  6865. 7 8 1 0 0 0 0
  6866. 7 9 1 0 0 0 0
  6867. 7 10 1 0 0 0 0
  6868. 11 12 1 0 0 0 0
  6869. 11 13 1 0 0 0 0
  6870. 11 14 1 0 0 0 0
  6871. 14 15 2 0 0 0 0
  6872. 14 16 1 0 0 0 0
  6873. 16 17 1 0 0 0 0
  6874. 17 18 1 0 0 0 0
  6875. 17 19 1 0 0 0 0
  6876. 17 20 1 0 0 0 0
  6877. 20 21 1 0 0 0 0
  6878. 20 22 1 0 0 0 0
  6879. 20 23 1 0 0 0 0
  6880. M END
  6881. $$$$
  6882. dan219.sdf
  6883. MOE2004 3D
  6884. 23 22 0 0 0 0 0 0 0 0999 V2000
  6885. 3.5340 0.1070 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0
  6886. 3.8790 -0.9310 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0
  6887. 4.2630 0.6840 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0
  6888. 3.5220 0.5020 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0
  6889. 2.1580 0.2030 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0
  6890. 1.8720 1.2580 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0
  6891. 2.2140 -0.1690 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0
  6892. 1.1160 -0.5940 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0
  6893. 1.4660 -1.6270 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0
  6894. 1.0230 -0.1830 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0
  6895. -0.2630 -0.6290 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
  6896. -0.1740 -1.0570 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0
  6897. -0.8970 -1.3140 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0
  6898. -0.9390 0.7440 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0
  6899. -0.9810 1.1940 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
  6900. -0.3380 1.4120 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0
  6901. -2.3410 0.6720 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0
  6902. -2.7060 1.6810 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0
  6903. -2.3370 0.1360 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0
  6904. -3.3330 0.0540 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0
  6905. -3.7520 0.6140 1.2220 O 0 0 0 0 0 0 0 0 0 0 0 0
  6906. -3.7020 -1.2060 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0
  6907. -3.2840 -1.5510 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0
  6908. 1 2 1 0 0 0 0
  6909. 1 3 1 0 0 0 0
  6910. 1 4 1 0 0 0 0
  6911. 1 5 1 0 0 0 0
  6912. 5 6 1 0 0 0 0
  6913. 5 7 1 0 0 0 0
  6914. 5 8 1 0 0 0 0
  6915. 8 9 1 0 0 0 0
  6916. 8 10 1 0 0 0 0
  6917. 8 11 1 0 0 0 0
  6918. 11 12 1 0 0 0 0
  6919. 11 13 1 0 0 0 0
  6920. 11 14 1 0 0 0 0
  6921. 14 15 1 0 0 0 0
  6922. 14 16 1 0 0 0 0
  6923. 14 17 1 0 0 0 0
  6924. 17 18 1 0 0 0 0
  6925. 17 19 1 0 0 0 0
  6926. 17 20 1 0 0 0 0
  6927. 20 21 2 0 0 0 0
  6928. 20 22 1 0 0 0 0
  6929. 22 23 1 0 0 0 0
  6930. M END
  6931. $$$$
  6932. dan220.sdf
  6933. MOE2004 3D
  6934. 23 22 0 0 0 0 0 0 0 0999 V2000
  6935. -3.7260 0.1130 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
  6936. -4.0870 -0.7020 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0
  6937. -4.3520 0.9910 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0
  6938. -3.8630 -0.1800 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
  6939. -2.2680 0.4310 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0
  6940. -1.9630 1.2760 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  6941. -2.1730 0.7480 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
  6942. -1.3680 -0.7790 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0
  6943. -1.7450 -1.6340 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0
  6944. -1.4260 -1.0620 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0
  6945. 0.0940 -0.5490 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0
  6946. 0.1490 -0.2580 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0
  6947. 0.6210 -1.5060 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0
  6948. 0.8030 0.5000 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0
  6949. 0.7380 0.1970 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0
  6950. 0.3050 1.4700 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0
  6951. 2.2700 0.6710 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0
  6952. 2.7100 1.4750 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0
  6953. 2.3550 0.9320 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0
  6954. 2.9750 -0.5500 -0.3550 O 0 0 0 0 0 0 0 0 0 0 0 0
  6955. 4.2960 -0.5160 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0
  6956. 4.7450 -1.4940 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0
  6957. 4.9090 0.4260 0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0
  6958. 1 2 1 0 0 0 0
  6959. 1 3 1 0 0 0 0
  6960. 1 4 1 0 0 0 0
  6961. 1 5 1 0 0 0 0
  6962. 5 6 1 0 0 0 0
  6963. 5 7 1 0 0 0 0
  6964. 5 8 1 0 0 0 0
  6965. 8 9 1 0 0 0 0
  6966. 8 10 1 0 0 0 0
  6967. 8 11 1 0 0 0 0
  6968. 11 12 1 0 0 0 0
  6969. 11 13 1 0 0 0 0
  6970. 11 14 1 0 0 0 0
  6971. 14 15 1 0 0 0 0
  6972. 14 16 1 0 0 0 0
  6973. 14 17 1 0 0 0 0
  6974. 17 18 1 0 0 0 0
  6975. 17 19 1 0 0 0 0
  6976. 17 20 1 0 0 0 0
  6977. 20 21 1 0 0 0 0
  6978. 21 22 1 0 0 0 0
  6979. 21 23 2 0 0 0 0
  6980. M END
  6981. $$$$
  6982. dan221.sdf
  6983. MOE2004 3D
  6984. 23 22 0 0 0 0 0 0 0 0999 V2000
  6985. -3.3700 0.4700 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0
  6986. -3.9130 0.3630 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0
  6987. -3.4060 -0.4880 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0
  6988. -3.8980 1.2080 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0
  6989. -1.9360 0.9180 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0
  6990. -1.9550 1.9090 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0
  6991. -1.4330 1.0270 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0
  6992. -1.1630 -0.0370 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0
  6993. -1.7490 -0.2610 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0
  6994. -0.2480 0.4270 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  6995. -0.8450 -1.3540 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0
  6996. -1.5680 -2.3330 -0.2630 O 0 0 0 0 0 0 0 0 0 0 0 0
  6997. 0.2510 -1.4130 0.6970 O 0 0 0 0 0 0 0 0 0 0 0 0
  6998. 1.2500 -0.3810 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0
  6999. 1.6870 -0.4590 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0
  7000. 0.8160 0.6190 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0
  7001. 2.3310 -0.6110 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0
  7002. 1.8880 -0.6300 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  7003. 2.7770 -1.6020 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0
  7004. 3.4120 0.4540 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
  7005. 2.9940 1.4490 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0
  7006. 3.9010 0.4620 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0
  7007. 4.1770 0.2630 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0
  7008. 1 2 1 0 0 0 0
  7009. 1 3 1 0 0 0 0
  7010. 1 4 1 0 0 0 0
  7011. 1 5 1 0 0 0 0
  7012. 5 6 1 0 0 0 0
  7013. 5 7 1 0 0 0 0
  7014. 5 8 1 0 0 0 0
  7015. 8 9 1 0 0 0 0
  7016. 8 10 1 0 0 0 0
  7017. 8 11 1 0 0 0 0
  7018. 11 12 2 0 0 0 0
  7019. 11 13 1 0 0 0 0
  7020. 13 14 1 0 0 0 0
  7021. 14 15 1 0 0 0 0
  7022. 14 16 1 0 0 0 0
  7023. 14 17 1 0 0 0 0
  7024. 17 18 1 0 0 0 0
  7025. 17 19 1 0 0 0 0
  7026. 17 20 1 0 0 0 0
  7027. 20 21 1 0 0 0 0
  7028. 20 22 1 0 0 0 0
  7029. 20 23 1 0 0 0 0
  7030. M END
  7031. $$$$
  7032. dan222.sdf
  7033. MOE2004 3D
  7034. 24 23 0 0 0 0 0 0 0 0999 V2000
  7035. -3.1790 -0.3460 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0
  7036. -2.8770 0.2810 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0
  7037. -4.2690 -0.4430 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  7038. -2.7560 -1.3440 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0
  7039. -2.7380 0.2670 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0
  7040. -3.0280 -0.3960 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0
  7041. -3.2830 1.2060 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0
  7042. -1.2370 0.5580 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0
  7043. -1.0330 1.0920 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0
  7044. -0.9680 1.2380 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0
  7045. -0.3720 -0.7050 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0
  7046. -0.4690 -1.1850 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0
  7047. -0.7410 -1.4240 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  7048. 1.1110 -0.4450 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0
  7049. 1.6130 -1.4150 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0
  7050. 1.2170 0.0340 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0
  7051. 1.7970 0.4110 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0
  7052. 1.3110 1.3890 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0
  7053. 1.6860 -0.0810 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7054. 3.2800 0.6340 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0
  7055. 3.4420 1.0610 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0
  7056. 3.6960 1.3300 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  7057. 4.0120 -0.5810 0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0
  7058. 3.7820 -1.1340 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0
  7059. 1 2 1 0 0 0 0
  7060. 1 3 1 0 0 0 0
  7061. 1 4 1 0 0 0 0
  7062. 1 5 1 0 0 0 0
  7063. 5 6 1 0 0 0 0
  7064. 5 7 1 0 0 0 0
  7065. 5 8 1 0 0 0 0
  7066. 8 9 1 0 0 0 0
  7067. 8 10 1 0 0 0 0
  7068. 8 11 1 0 0 0 0
  7069. 11 12 1 0 0 0 0
  7070. 11 13 1 0 0 0 0
  7071. 11 14 1 0 0 0 0
  7072. 14 15 1 0 0 0 0
  7073. 14 16 1 0 0 0 0
  7074. 14 17 1 0 0 0 0
  7075. 17 18 1 0 0 0 0
  7076. 17 19 1 0 0 0 0
  7077. 17 20 1 0 0 0 0
  7078. 20 21 1 0 0 0 0
  7079. 20 22 1 0 0 0 0
  7080. 20 23 1 0 0 0 0
  7081. 23 24 1 0 0 0 0
  7082. M END
  7083. $$$$
  7084. dan223.sdf
  7085. MOE2004 3D
  7086. 24 23 0 0 1 0 0 0 0 0999 V2000
  7087. -2.9200 1.1060 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0
  7088. -3.9770 1.1130 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0
  7089. -2.7320 1.9690 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
  7090. -2.3550 1.2240 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0
  7091. -2.5740 -0.2020 0.3240 C 0 0 3 0 0 0 0 0 0 0 0 0
  7092. -1.1450 -0.2370 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0
  7093. -1.0030 -1.1910 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7094. -1.0290 0.5560 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0
  7095. -0.0460 -0.1050 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0
  7096. -0.1430 0.8530 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0
  7097. -0.1580 -0.8940 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0
  7098. 1.3480 -0.1940 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0
  7099. 1.4600 -1.1560 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0
  7100. 1.4600 0.5880 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
  7101. 2.4440 -0.0430 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0
  7102. 2.3400 0.9200 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0
  7103. 2.3410 -0.8250 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0
  7104. 3.8310 -0.1300 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
  7105. 3.9800 0.6590 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0
  7106. 3.9830 -1.0960 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0
  7107. 4.5980 -0.0170 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0
  7108. -2.7550 -1.2870 -0.5830 O 0 0 0 0 0 0 0 0 0 0 0 0
  7109. -3.6750 -1.2600 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  7110. -3.2720 -0.3520 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
  7111. 1 2 1 0 0 0 0
  7112. 1 3 1 0 0 0 0
  7113. 1 4 1 0 0 0 0
  7114. 1 5 1 0 0 0 0
  7115. 5 6 1 0 0 0 0
  7116. 5 22 1 0 0 0 0
  7117. 5 24 1 0 0 0 0
  7118. 6 7 1 0 0 0 0
  7119. 6 8 1 0 0 0 0
  7120. 6 9 1 0 0 0 0
  7121. 9 10 1 0 0 0 0
  7122. 9 11 1 0 0 0 0
  7123. 9 12 1 0 0 0 0
  7124. 12 13 1 0 0 0 0
  7125. 12 14 1 0 0 0 0
  7126. 12 15 1 0 0 0 0
  7127. 15 16 1 0 0 0 0
  7128. 15 17 1 0 0 0 0
  7129. 15 18 1 0 0 0 0
  7130. 18 19 1 0 0 0 0
  7131. 18 20 1 0 0 0 0
  7132. 18 21 1 0 0 0 0
  7133. 22 23 1 0 0 0 0
  7134. M END
  7135. $$$$
  7136. dan224.sdf
  7137. MOE2004 3D
  7138. 24 23 0 0 0 0 0 0 0 0999 V2000
  7139. 2.7740 0.5250 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0
  7140. 2.6900 1.3730 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0
  7141. 2.4470 0.8530 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0
  7142. 1.9640 -0.6660 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0
  7143. 2.0580 -1.4990 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0
  7144. 2.4120 -1.0270 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  7145. 0.4870 -0.3490 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0
  7146. 0.0340 -1.2250 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
  7147. 0.4140 0.4730 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0
  7148. -0.2800 -0.0020 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0
  7149. -0.1200 -0.7970 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0
  7150. 0.1420 0.9090 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0
  7151. -1.7970 0.2110 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0
  7152. -2.1950 0.4770 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
  7153. -2.5180 -1.0610 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0
  7154. -3.6040 -0.9170 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0
  7155. -2.2510 -1.3460 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0
  7156. -2.2800 -1.9000 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0
  7157. -2.1190 1.3700 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0
  7158. -3.1930 1.5830 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
  7159. -1.5990 2.2820 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0
  7160. -1.8340 1.1460 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0
  7161. 4.1490 0.1680 0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0
  7162. 4.2190 -0.5790 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0
  7163. 1 2 1 0 0 0 0
  7164. 1 3 1 0 0 0 0
  7165. 1 4 1 0 0 0 0
  7166. 1 23 1 0 0 0 0
  7167. 4 5 1 0 0 0 0
  7168. 4 6 1 0 0 0 0
  7169. 4 7 1 0 0 0 0
  7170. 7 8 1 0 0 0 0
  7171. 7 9 1 0 0 0 0
  7172. 7 10 1 0 0 0 0
  7173. 10 11 1 0 0 0 0
  7174. 10 12 1 0 0 0 0
  7175. 10 13 1 0 0 0 0
  7176. 13 14 1 0 0 0 0
  7177. 13 15 1 0 0 0 0
  7178. 13 19 1 0 0 0 0
  7179. 15 16 1 0 0 0 0
  7180. 15 17 1 0 0 0 0
  7181. 15 18 1 0 0 0 0
  7182. 19 20 1 0 0 0 0
  7183. 19 21 1 0 0 0 0
  7184. 19 22 1 0 0 0 0
  7185. 23 24 1 0 0 0 0
  7186. M END
  7187. $$$$
  7188. dan225.sdf
  7189. MOE2004 3D
  7190. 24 23 0 0 0 0 0 0 0 0999 V2000
  7191. -3.0640 -0.4830 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0
  7192. -3.5200 -0.8770 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0
  7193. -2.5620 -1.3050 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0
  7194. -3.8670 -0.1250 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0
  7195. -2.1010 0.6520 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0
  7196. -2.6750 1.4920 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
  7197. -1.6470 1.0130 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7198. -1.0180 0.2730 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0
  7199. -1.5010 -0.0010 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0
  7200. -0.4190 1.1630 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0
  7201. -0.0920 -0.8770 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0
  7202. -0.6760 -1.8000 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0
  7203. 0.6220 -1.0580 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0
  7204. 0.6720 -0.6700 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0
  7205. -0.0410 -0.6300 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  7206. 1.2820 -1.5600 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  7207. 1.5580 0.5840 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0
  7208. 0.9190 1.4730 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0
  7209. 2.0470 0.6130 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0
  7210. 2.6180 0.7180 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0
  7211. 2.1580 0.7470 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  7212. 3.1540 1.6640 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  7213. 3.8510 -0.6180 -0.3150 S 0 0 0 0 0 0 0 0 0 0 0 0
  7214. 4.3020 -0.3870 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0
  7215. 1 2 1 0 0 0 0
  7216. 1 3 1 0 0 0 0
  7217. 1 4 1 0 0 0 0
  7218. 1 5 1 0 0 0 0
  7219. 5 6 1 0 0 0 0
  7220. 5 7 1 0 0 0 0
  7221. 5 8 1 0 0 0 0
  7222. 8 9 1 0 0 0 0
  7223. 8 10 1 0 0 0 0
  7224. 8 11 1 0 0 0 0
  7225. 11 12 1 0 0 0 0
  7226. 11 13 1 0 0 0 0
  7227. 11 14 1 0 0 0 0
  7228. 14 15 1 0 0 0 0
  7229. 14 16 1 0 0 0 0
  7230. 14 17 1 0 0 0 0
  7231. 17 18 1 0 0 0 0
  7232. 17 19 1 0 0 0 0
  7233. 17 20 1 0 0 0 0
  7234. 20 21 1 0 0 0 0
  7235. 20 22 1 0 0 0 0
  7236. 20 23 1 0 0 0 0
  7237. 23 24 1 0 0 0 0
  7238. M END
  7239. $$$$
  7240. dan226.sdf
  7241. MOE2004 3D
  7242. 19 19 0 0 0 0 0 0 0 0999 V2000
  7243. 1.7290 1.1380 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  7244. 2.6100 1.7760 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  7245. 0.4590 1.7130 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  7246. 0.3770 2.7960 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7247. -0.6800 0.8970 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  7248. -0.5500 -0.5070 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0
  7249. 0.7320 -1.0680 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0
  7250. 0.8310 -2.1510 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0
  7251. 1.8600 -0.2480 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0
  7252. 3.1880 -0.8650 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0
  7253. 3.2250 -1.9670 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0
  7254. 4.2130 -0.1950 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0
  7255. -1.5550 -1.4650 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0
  7256. -2.9060 -1.0170 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  7257. -3.0710 -0.4580 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0
  7258. -3.2000 -0.4450 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0
  7259. -3.5440 -1.9040 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0
  7260. -1.9160 1.5030 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0
  7261. -1.8010 2.4680 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0
  7262. 1 2 1 0 0 0 0
  7263. 1 3 1 0 0 0 0
  7264. 1 9 2 0 0 0 0
  7265. 3 4 1 0 0 0 0
  7266. 3 5 2 0 0 0 0
  7267. 5 6 1 0 0 0 0
  7268. 5 18 1 0 0 0 0
  7269. 6 7 2 0 0 0 0
  7270. 6 13 1 0 0 0 0
  7271. 7 8 1 0 0 0 0
  7272. 7 9 1 0 0 0 0
  7273. 9 10 1 0 0 0 0
  7274. 10 11 1 0 0 0 0
  7275. 10 12 2 0 0 0 0
  7276. 13 14 1 0 0 0 0
  7277. 14 15 1 0 0 0 0
  7278. 14 16 1 0 0 0 0
  7279. 14 17 1 0 0 0 0
  7280. 18 19 1 0 0 0 0
  7281. M END
  7282. $$$$
  7283. dan227.sdf
  7284. MOE2004 3D
  7285. 19 19 0 0 0 0 0 0 0 0999 V2000
  7286. -0.1610 0.9530 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0
  7287. 0.4860 1.8260 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0
  7288. -1.5420 1.1590 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  7289. -1.9280 2.1730 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  7290. -2.3980 0.0600 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7291. -1.8950 -1.2330 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  7292. -2.5720 -2.0810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
  7293. -0.5140 -1.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7294. -0.1320 -2.4520 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  7295. 0.3760 -0.3460 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  7296. 1.8620 -0.6410 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0
  7297. 2.0880 -1.2250 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0
  7298. 2.0900 -1.2750 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0
  7299. 2.8040 0.5560 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0
  7300. 2.6650 1.2010 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0
  7301. 2.6520 1.1590 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0
  7302. 3.8450 0.2160 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0
  7303. -3.7620 0.2160 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0
  7304. -3.9630 1.1670 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  7305. 1 2 1 0 0 0 0
  7306. 1 3 1 0 0 0 0
  7307. 1 10 2 0 0 0 0
  7308. 3 4 1 0 0 0 0
  7309. 3 5 2 0 0 0 0
  7310. 5 6 1 0 0 0 0
  7311. 5 18 1 0 0 0 0
  7312. 6 7 1 0 0 0 0
  7313. 6 8 2 0 0 0 0
  7314. 8 9 1 0 0 0 0
  7315. 8 10 1 0 0 0 0
  7316. 10 11 1 0 0 0 0
  7317. 11 12 1 0 0 0 0
  7318. 11 13 1 0 0 0 0
  7319. 11 14 1 0 0 0 0
  7320. 14 15 1 0 0 0 0
  7321. 14 16 1 0 0 0 0
  7322. 14 17 1 0 0 0 0
  7323. 18 19 1 0 0 0 0
  7324. M END
  7325. $$$$
  7326. dan228.sdf
  7327. MOE2004 3D
  7328. 19 19 0 0 0 0 0 0 0 0999 V2000
  7329. -0.2590 0.5840 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0
  7330. -1.5030 -0.0700 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  7331. -1.5980 -1.4630 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  7332. -2.5610 -1.9640 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
  7333. -0.4370 -2.2280 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0
  7334. -0.5000 -3.3120 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0
  7335. 0.8080 -1.6040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  7336. 1.7020 -2.2230 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7337. 0.9160 -0.2030 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7338. -0.1910 2.0910 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0
  7339. -1.0930 2.5470 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
  7340. 0.6420 2.4580 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0
  7341. -0.0670 2.4480 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0
  7342. 2.2860 0.4210 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0
  7343. 2.3600 1.1830 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0
  7344. 2.5000 0.8770 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0
  7345. 3.0660 -0.3210 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  7346. -2.6530 0.6880 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0
  7347. -3.4200 0.0910 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0
  7348. 1 2 2 0 0 0 0
  7349. 1 9 1 0 0 0 0
  7350. 1 10 1 0 0 0 0
  7351. 2 3 1 0 0 0 0
  7352. 2 18 1 0 0 0 0
  7353. 3 4 1 0 0 0 0
  7354. 3 5 2 0 0 0 0
  7355. 5 6 1 0 0 0 0
  7356. 5 7 1 0 0 0 0
  7357. 7 8 1 0 0 0 0
  7358. 7 9 2 0 0 0 0
  7359. 9 14 1 0 0 0 0
  7360. 10 11 1 0 0 0 0
  7361. 10 12 1 0 0 0 0
  7362. 10 13 1 0 0 0 0
  7363. 14 15 1 0 0 0 0
  7364. 14 16 1 0 0 0 0
  7365. 14 17 1 0 0 0 0
  7366. 18 19 1 0 0 0 0
  7367. M END
  7368. $$$$
  7369. dan229.sdf
  7370. MOE2004 3D
  7371. 19 19 0 0 0 0 0 0 0 0999 V2000
  7372. -0.3680 1.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7373. -0.6400 2.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7374. 0.9820 1.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7375. 1.7350 2.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7376. 1.3670 0.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7377. 0.3780 -0.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7378. 0.6700 -1.9510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7379. -0.9850 -0.5720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7380. -1.3410 0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7381. 2.8250 -0.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7382. 2.9720 -1.3560 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
  7383. 3.3130 0.1270 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  7384. 3.3170 0.1380 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
  7385. -2.0050 -1.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7386. -3.0330 -1.3020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  7387. -1.8840 -2.2990 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  7388. -1.8810 -2.3010 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0
  7389. -2.6740 1.1240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  7390. -2.7480 2.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7391. 1 2 1 0 0 0 0
  7392. 1 3 1 0 0 0 0
  7393. 1 9 2 0 0 0 0
  7394. 3 4 1 0 0 0 0
  7395. 3 5 2 0 0 0 0
  7396. 5 6 1 0 0 0 0
  7397. 5 10 1 0 0 0 0
  7398. 6 7 1 0 0 0 0
  7399. 6 8 2 0 0 0 0
  7400. 8 9 1 0 0 0 0
  7401. 8 14 1 0 0 0 0
  7402. 9 18 1 0 0 0 0
  7403. 10 11 1 0 0 0 0
  7404. 10 12 1 0 0 0 0
  7405. 10 13 1 0 0 0 0
  7406. 14 15 1 0 0 0 0
  7407. 14 16 1 0 0 0 0
  7408. 14 17 1 0 0 0 0
  7409. 18 19 1 0 0 0 0
  7410. M END
  7411. $$$$
  7412. dan230.sdf
  7413. MOE2004 3D
  7414. 19 19 0 0 0 0 0 0 0 0999 V2000
  7415. 0.5310 -1.1760 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7416. 0.8820 -2.2030 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7417. 1.4620 -0.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7418. 0.9990 1.1910 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7419. 1.7040 2.0180 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7420. -0.3700 1.4650 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7421. -0.7030 2.5000 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7422. -1.3100 0.4250 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  7423. -0.8380 -0.8940 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7424. 2.9380 -0.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7425. 3.1480 -1.4800 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0
  7426. 3.3990 0.0050 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0
  7427. 3.4080 0.0460 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  7428. -2.7740 0.7630 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7429. -3.4120 -0.1250 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
  7430. -3.0260 1.3330 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7431. -3.0230 1.3620 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0
  7432. -1.7490 -1.9260 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  7433. -1.2660 -2.7690 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7434. 1 2 1 0 0 0 0
  7435. 1 3 1 0 0 0 0
  7436. 1 9 2 0 0 0 0
  7437. 3 4 2 0 0 0 0
  7438. 3 10 1 0 0 0 0
  7439. 4 5 1 0 0 0 0
  7440. 4 6 1 0 0 0 0
  7441. 6 7 1 0 0 0 0
  7442. 6 8 2 0 0 0 0
  7443. 8 9 1 0 0 0 0
  7444. 8 14 1 0 0 0 0
  7445. 9 18 1 0 0 0 0
  7446. 10 11 1 0 0 0 0
  7447. 10 12 1 0 0 0 0
  7448. 10 13 1 0 0 0 0
  7449. 14 15 1 0 0 0 0
  7450. 14 16 1 0 0 0 0
  7451. 14 17 1 0 0 0 0
  7452. 18 19 1 0 0 0 0
  7453. M END
  7454. $$$$
  7455. dan231.sdf
  7456. MOE2004 3D
  7457. 19 19 0 0 0 0 0 0 0 0999 V2000
  7458. 1.2090 -1.3650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7459. 2.1570 -1.8980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7460. 1.1830 0.0370 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7461. -0.0710 0.6790 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7462. -1.2700 -0.0520 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7463. -1.2050 -1.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7464. -2.1160 -2.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7465. 0.0260 -2.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7466. 0.0640 -3.1870 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7467. 2.4810 0.7960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7468. 2.5520 1.4290 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0
  7469. 3.3450 0.1230 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0
  7470. 2.5570 1.4190 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  7471. -2.6020 0.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7472. -2.7020 1.2770 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  7473. -2.7080 1.2630 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  7474. -3.4310 -0.0710 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0
  7475. -0.1780 2.0550 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0
  7476. 0.7090 2.4470 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7477. 1 2 1 0 0 0 0
  7478. 1 3 2 0 0 0 0
  7479. 1 8 1 0 0 0 0
  7480. 3 4 1 0 0 0 0
  7481. 3 10 1 0 0 0 0
  7482. 4 5 2 0 0 0 0
  7483. 4 18 1 0 0 0 0
  7484. 5 6 1 0 0 0 0
  7485. 5 14 1 0 0 0 0
  7486. 6 7 1 0 0 0 0
  7487. 6 8 2 0 0 0 0
  7488. 8 9 1 0 0 0 0
  7489. 10 11 1 0 0 0 0
  7490. 10 12 1 0 0 0 0
  7491. 10 13 1 0 0 0 0
  7492. 14 15 1 0 0 0 0
  7493. 14 16 1 0 0 0 0
  7494. 14 17 1 0 0 0 0
  7495. 18 19 1 0 0 0 0
  7496. M END
  7497. $$$$
  7498. dan232.sdf
  7499. MOE2004 3D
  7500. 19 19 0 0 0 0 0 0 0 0999 V2000
  7501. -0.2550 -0.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7502. 1.1150 -1.0660 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7503. 1.4560 -2.0980 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7504. 2.0580 -0.0460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7505. 1.6690 1.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7506. 2.4000 2.0920 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7507. 0.3110 1.6020 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7508. 0.0130 2.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7509. -0.6630 0.5890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  7510. -1.2580 -1.8880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  7511. -1.9040 -1.8240 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
  7512. -0.7670 -2.8670 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0
  7513. -1.8710 -1.8510 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0
  7514. -2.1200 0.9680 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7515. -2.6290 0.5430 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0
  7516. -2.2560 2.0540 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0
  7517. -2.6050 0.6110 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0
  7518. 3.3850 -0.4020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  7519. 3.9210 0.4090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7520. 1 2 1 0 0 0 0
  7521. 1 9 2 0 0 0 0
  7522. 1 10 1 0 0 0 0
  7523. 2 3 1 0 0 0 0
  7524. 2 4 2 0 0 0 0
  7525. 4 5 1 0 0 0 0
  7526. 4 18 1 0 0 0 0
  7527. 5 6 1 0 0 0 0
  7528. 5 7 2 0 0 0 0
  7529. 7 8 1 0 0 0 0
  7530. 7 9 1 0 0 0 0
  7531. 9 14 1 0 0 0 0
  7532. 10 11 1 0 0 0 0
  7533. 10 12 1 0 0 0 0
  7534. 10 13 1 0 0 0 0
  7535. 14 15 1 0 0 0 0
  7536. 14 16 1 0 0 0 0
  7537. 14 17 1 0 0 0 0
  7538. 18 19 1 0 0 0 0
  7539. M END
  7540. $$$$
  7541. dan233.sdf
  7542. MOE2004 3D
  7543. 19 19 0 0 0 0 0 0 0 0999 V2000
  7544. -0.9990 1.2340 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7545. -1.8460 1.9130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7546. -1.2140 -0.1500 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7547. -0.1090 -1.0140 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7548. -0.2710 -2.0900 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7549. 1.2020 -0.5150 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7550. 1.4010 0.8700 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7551. 2.4030 1.2880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7552. 0.3060 1.7270 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7553. -2.6050 -0.7160 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7554. -3.3630 0.0740 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0
  7555. -2.7600 -1.3410 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
  7556. -2.7660 -1.3210 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0
  7557. 2.3650 -1.4630 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  7558. 3.3210 -0.9290 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0
  7559. 2.3420 -2.0890 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0
  7560. 2.3320 -2.1050 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0
  7561. 0.5560 3.0790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  7562. -0.2940 3.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7563. 1 2 1 0 0 0 0
  7564. 1 3 1 0 0 0 0
  7565. 1 9 2 0 0 0 0
  7566. 3 4 2 0 0 0 0
  7567. 3 10 1 0 0 0 0
  7568. 4 5 1 0 0 0 0
  7569. 4 6 1 0 0 0 0
  7570. 6 7 2 0 0 0 0
  7571. 6 14 1 0 0 0 0
  7572. 7 8 1 0 0 0 0
  7573. 7 9 1 0 0 0 0
  7574. 9 18 1 0 0 0 0
  7575. 10 11 1 0 0 0 0
  7576. 10 12 1 0 0 0 0
  7577. 10 13 1 0 0 0 0
  7578. 14 15 1 0 0 0 0
  7579. 14 16 1 0 0 0 0
  7580. 14 17 1 0 0 0 0
  7581. 18 19 1 0 0 0 0
  7582. M END
  7583. $$$$
  7584. dan234.sdf
  7585. MOE2004 3D
  7586. 24 23 0 0 0 0 0 0 0 0999 V2000
  7587. -4.9220 -0.2880 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0
  7588. -5.3280 0.6250 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0
  7589. -5.6420 -1.0990 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0
  7590. -4.8110 -0.0930 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0
  7591. -3.5840 -0.6380 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0
  7592. -3.1830 -1.5420 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0
  7593. -3.7100 -0.8100 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0
  7594. -2.6880 0.4600 0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0
  7595. -1.4360 0.2600 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0
  7596. -1.0380 -0.7180 -1.0590 O 0 0 0 0 0 0 0 0 0 0 0 0
  7597. -0.6460 1.4570 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0
  7598. -1.1730 2.4000 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0
  7599. 0.6420 1.4490 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0
  7600. 1.1730 2.3870 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
  7601. 1.4260 0.2410 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0
  7602. 1.0170 -0.7580 0.9870 O 0 0 0 0 0 0 0 0 0 0 0 0
  7603. 2.6870 0.4590 -0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0
  7604. 3.5820 -0.6440 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  7605. 3.1940 -1.5320 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0
  7606. 3.6830 -0.8540 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0
  7607. 4.9330 -0.2690 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0
  7608. 4.8470 -0.0420 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0
  7609. 5.3240 0.6310 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
  7610. 5.6530 -1.0820 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0
  7611. 1 2 1 0 0 0 0
  7612. 1 3 1 0 0 0 0
  7613. 1 4 1 0 0 0 0
  7614. 1 5 1 0 0 0 0
  7615. 5 6 1 0 0 0 0
  7616. 5 7 1 0 0 0 0
  7617. 5 8 1 0 0 0 0
  7618. 8 9 1 0 0 0 0
  7619. 9 10 2 0 0 0 0
  7620. 9 11 1 0 0 0 0
  7621. 11 12 1 0 0 0 0
  7622. 11 13 2 0 0 0 0
  7623. 13 14 1 0 0 0 0
  7624. 13 15 1 0 0 0 0
  7625. 15 16 2 0 0 0 0
  7626. 15 17 1 0 0 0 0
  7627. 17 18 1 0 0 0 0
  7628. 18 19 1 0 0 0 0
  7629. 18 20 1 0 0 0 0
  7630. 18 21 1 0 0 0 0
  7631. 21 22 1 0 0 0 0
  7632. 21 23 1 0 0 0 0
  7633. 21 24 1 0 0 0 0
  7634. M END
  7635. $$$$
  7636. dan235.sdf
  7637. MOE2004 3D
  7638. 25 24 0 0 0 0 0 0 0 0999 V2000
  7639. -3.1770 0.4180 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0
  7640. -3.5710 1.3170 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0
  7641. -4.0270 -0.1980 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0
  7642. -2.6400 0.7190 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0
  7643. -2.2820 -0.3660 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0
  7644. -1.8990 -1.2540 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0
  7645. -2.8940 -0.7340 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  7646. -1.1290 0.4600 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  7647. -0.5800 -0.1600 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0
  7648. -1.5460 1.2900 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0
  7649. -0.1480 1.0390 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  7650. 0.6240 1.6030 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0
  7651. -0.6670 1.7800 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0
  7652. 0.5210 0.0180 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0
  7653. 1.1960 0.5570 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0
  7654. -0.2380 -0.4340 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0
  7655. 1.2970 -1.1090 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0
  7656. 1.6990 -1.7730 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
  7657. 0.6090 -1.7190 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0
  7658. 2.4400 -0.6370 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0
  7659. 2.8960 -1.5000 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0
  7660. 2.0880 0.0410 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0
  7661. 3.5240 0.0390 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0
  7662. 3.9530 -0.5530 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0
  7663. 3.9490 1.1590 -0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0
  7664. 1 2 1 0 0 0 0
  7665. 1 3 1 0 0 0 0
  7666. 1 4 1 0 0 0 0
  7667. 1 5 1 0 0 0 0
  7668. 5 6 1 0 0 0 0
  7669. 5 7 1 0 0 0 0
  7670. 5 8 1 0 0 0 0
  7671. 8 9 1 0 0 0 0
  7672. 8 10 1 0 0 0 0
  7673. 8 11 1 0 0 0 0
  7674. 11 12 1 0 0 0 0
  7675. 11 13 1 0 0 0 0
  7676. 11 14 1 0 0 0 0
  7677. 14 15 1 0 0 0 0
  7678. 14 16 1 0 0 0 0
  7679. 14 17 1 0 0 0 0
  7680. 17 18 1 0 0 0 0
  7681. 17 19 1 0 0 0 0
  7682. 17 20 1 0 0 0 0
  7683. 20 21 1 0 0 0 0
  7684. 20 22 1 0 0 0 0
  7685. 20 23 1 0 0 0 0
  7686. 23 24 1 0 0 0 0
  7687. 23 25 2 0 0 0 0
  7688. M END
  7689. $$$$
  7690. dan236.sdf
  7691. MOE2004 3D
  7692. 25 24 0 0 0 0 0 0 0 0999 V2000
  7693. 4.0290 0.3180 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0
  7694. 4.3860 0.8140 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0
  7695. 4.0190 1.0520 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0
  7696. 4.7470 -0.4660 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0
  7697. 2.6470 -0.2810 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  7698. 2.6980 -1.0280 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0
  7699. 2.3490 -0.8040 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0
  7700. 1.6220 0.7970 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
  7701. 1.5380 1.5150 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0
  7702. 1.9820 1.3600 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0
  7703. 0.2370 0.2370 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0
  7704. -0.3830 1.0660 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0
  7705. 0.3190 -0.4710 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0
  7706. -0.4520 -0.4430 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0
  7707. 0.1140 -1.3360 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0
  7708. -0.4470 0.2250 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0
  7709. -1.8830 -0.8750 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0
  7710. -1.9020 -1.4190 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0
  7711. -2.2440 -1.5510 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0
  7712. -2.8680 0.2780 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0
  7713. -4.2260 -0.0440 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0
  7714. -4.8430 0.8590 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
  7715. -4.1200 -0.4170 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0
  7716. -4.7160 -0.7940 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0
  7717. -2.6040 1.4070 0.5730 O 0 0 0 0 0 0 0 0 0 0 0 0
  7718. 1 2 1 0 0 0 0
  7719. 1 3 1 0 0 0 0
  7720. 1 4 1 0 0 0 0
  7721. 1 5 1 0 0 0 0
  7722. 5 6 1 0 0 0 0
  7723. 5 7 1 0 0 0 0
  7724. 5 8 1 0 0 0 0
  7725. 8 9 1 0 0 0 0
  7726. 8 10 1 0 0 0 0
  7727. 8 11 1 0 0 0 0
  7728. 11 12 1 0 0 0 0
  7729. 11 13 1 0 0 0 0
  7730. 11 14 1 0 0 0 0
  7731. 14 15 1 0 0 0 0
  7732. 14 16 1 0 0 0 0
  7733. 14 17 1 0 0 0 0
  7734. 17 18 1 0 0 0 0
  7735. 17 19 1 0 0 0 0
  7736. 17 20 1 0 0 0 0
  7737. 20 21 1 0 0 0 0
  7738. 20 25 2 0 0 0 0
  7739. 21 22 1 0 0 0 0
  7740. 21 23 1 0 0 0 0
  7741. 21 24 1 0 0 0 0
  7742. M END
  7743. $$$$
  7744. dan237.sdf
  7745. MOE2004 3D
  7746. 26 25 0 0 0 0 0 0 0 0999 V2000
  7747. 3.7820 0.1870 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0
  7748. 4.1650 -0.8010 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0
  7749. 4.6390 0.8350 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0
  7750. 3.2580 0.6050 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0
  7751. 2.8740 0.1060 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0
  7752. 2.4840 1.1040 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0
  7753. 3.4750 -0.2030 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0
  7754. 1.7170 -0.8790 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
  7755. 1.1840 -0.9620 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0
  7756. 2.1040 -1.8850 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
  7757. 0.7330 -0.4890 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0
  7758. 1.2170 -0.5560 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0
  7759. 0.3880 0.5430 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0
  7760. -0.3610 -1.4250 0.6580 O 0 0 0 0 0 0 0 0 0 0 0 0
  7761. -1.5060 -1.3020 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
  7762. -2.3330 -2.2060 -0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0
  7763. -1.7410 -0.0060 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0
  7764. -2.3980 -0.2290 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0
  7765. -0.8120 0.3440 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0
  7766. -2.3650 1.0730 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
  7767. -2.3210 2.0310 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0
  7768. -1.7950 1.1940 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0
  7769. -3.8170 0.7820 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0
  7770. -4.2360 1.6050 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0
  7771. -4.4250 0.6680 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7772. -3.9100 -0.1320 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0
  7773. 1 2 1 0 0 0 0
  7774. 1 3 1 0 0 0 0
  7775. 1 4 1 0 0 0 0
  7776. 1 5 1 0 0 0 0
  7777. 5 6 1 0 0 0 0
  7778. 5 7 1 0 0 0 0
  7779. 5 8 1 0 0 0 0
  7780. 8 9 1 0 0 0 0
  7781. 8 10 1 0 0 0 0
  7782. 8 11 1 0 0 0 0
  7783. 11 12 1 0 0 0 0
  7784. 11 13 1 0 0 0 0
  7785. 11 14 1 0 0 0 0
  7786. 14 15 1 0 0 0 0
  7787. 15 16 2 0 0 0 0
  7788. 15 17 1 0 0 0 0
  7789. 17 18 1 0 0 0 0
  7790. 17 19 1 0 0 0 0
  7791. 17 20 1 0 0 0 0
  7792. 20 21 1 0 0 0 0
  7793. 20 22 1 0 0 0 0
  7794. 20 23 1 0 0 0 0
  7795. 23 24 1 0 0 0 0
  7796. 23 25 1 0 0 0 0
  7797. 23 26 1 0 0 0 0
  7798. M END
  7799. $$$$
  7800. dan238.sdf
  7801. MOE2004 3D
  7802. 26 25 0 0 0 0 0 0 0 0999 V2000
  7803. -3.0290 -1.3200 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0
  7804. -3.9110 -0.7380 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0
  7805. -2.3250 -1.3080 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0
  7806. -3.3430 -2.3570 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0
  7807. -2.3960 -0.7720 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0
  7808. -3.1020 -0.9120 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0
  7809. -1.5100 -1.3640 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0
  7810. -2.0400 0.7150 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0
  7811. -2.9610 1.2900 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0
  7812. -1.6460 1.0360 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0
  7813. -1.0490 1.1000 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0
  7814. -1.5170 0.9370 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0
  7815. -0.8640 2.1790 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0
  7816. 0.2970 0.3660 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0
  7817. 0.1430 -0.7080 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0
  7818. 0.8800 0.7080 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0
  7819. 1.0990 0.6060 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0
  7820. 1.2470 1.6850 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0
  7821. 0.5410 0.2410 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0
  7822. 2.4580 -0.0880 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0
  7823. 2.9610 0.0630 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0
  7824. 2.3300 -1.1630 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0
  7825. 3.2620 0.4800 -0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0
  7826. 4.4930 -0.0880 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0
  7827. 5.0290 0.4120 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
  7828. 4.9550 -1.0020 0.1710 O 0 0 0 0 0 0 0 0 0 0 0 0
  7829. 1 2 1 0 0 0 0
  7830. 1 3 1 0 0 0 0
  7831. 1 4 1 0 0 0 0
  7832. 1 5 1 0 0 0 0
  7833. 5 6 1 0 0 0 0
  7834. 5 7 1 0 0 0 0
  7835. 5 8 1 0 0 0 0
  7836. 8 9 1 0 0 0 0
  7837. 8 10 1 0 0 0 0
  7838. 8 11 1 0 0 0 0
  7839. 11 12 1 0 0 0 0
  7840. 11 13 1 0 0 0 0
  7841. 11 14 1 0 0 0 0
  7842. 14 15 1 0 0 0 0
  7843. 14 16 1 0 0 0 0
  7844. 14 17 1 0 0 0 0
  7845. 17 18 1 0 0 0 0
  7846. 17 19 1 0 0 0 0
  7847. 17 20 1 0 0 0 0
  7848. 20 21 1 0 0 0 0
  7849. 20 22 1 0 0 0 0
  7850. 20 23 1 0 0 0 0
  7851. 23 24 1 0 0 0 0
  7852. 24 25 1 0 0 0 0
  7853. 24 26 2 0 0 0 0
  7854. M END
  7855. $$$$
  7856. dan239.sdf
  7857. MOE2004 3D
  7858. 26 25 0 0 0 0 0 0 0 0999 V2000
  7859. 4.3330 0.0060 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
  7860. 4.6310 -0.7680 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0
  7861. 4.4270 -0.4060 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0
  7862. 5.0350 0.8400 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0
  7863. 2.9130 0.4790 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0
  7864. 2.8620 0.9090 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0
  7865. 2.6730 1.2800 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0
  7866. 1.9070 -0.6670 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
  7867. 1.9240 -1.0620 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0
  7868. 2.2160 -1.4880 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0
  7869. 0.4760 -0.2700 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0
  7870. -0.1330 -1.1810 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0
  7871. 0.4630 0.1350 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0
  7872. -0.1510 0.7420 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0
  7873. 0.4260 1.6720 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0
  7874. -0.1200 0.3290 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0
  7875. -1.5960 1.0700 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0
  7876. -1.6480 1.4500 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  7877. -1.9780 1.8350 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0
  7878. -2.3970 -0.1130 -0.2680 O 0 0 0 0 0 0 0 0 0 0 0 0
  7879. -3.7080 0.0500 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0
  7880. -4.2230 1.0920 0.4570 O 0 0 0 0 0 0 0 0 0 0 0 0
  7881. -4.4420 -1.2480 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0
  7882. -4.0000 -2.0050 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0
  7883. -5.4890 -1.1100 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0
  7884. -4.4050 -1.5710 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0
  7885. 1 2 1 0 0 0 0
  7886. 1 3 1 0 0 0 0
  7887. 1 4 1 0 0 0 0
  7888. 1 5 1 0 0 0 0
  7889. 5 6 1 0 0 0 0
  7890. 5 7 1 0 0 0 0
  7891. 5 8 1 0 0 0 0
  7892. 8 9 1 0 0 0 0
  7893. 8 10 1 0 0 0 0
  7894. 8 11 1 0 0 0 0
  7895. 11 12 1 0 0 0 0
  7896. 11 13 1 0 0 0 0
  7897. 11 14 1 0 0 0 0
  7898. 14 15 1 0 0 0 0
  7899. 14 16 1 0 0 0 0
  7900. 14 17 1 0 0 0 0
  7901. 17 18 1 0 0 0 0
  7902. 17 19 1 0 0 0 0
  7903. 17 20 1 0 0 0 0
  7904. 20 21 1 0 0 0 0
  7905. 21 22 2 0 0 0 0
  7906. 21 23 1 0 0 0 0
  7907. 23 24 1 0 0 0 0
  7908. 23 25 1 0 0 0 0
  7909. 23 26 1 0 0 0 0
  7910. M END
  7911. $$$$
  7912. dan240.sdf
  7913. MOE2004 3D
  7914. 26 25 0 0 0 0 0 0 0 0999 V2000
  7915. 3.1950 0.7220 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0
  7916. 2.9890 1.1790 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0
  7917. 4.2390 0.3920 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0
  7918. 3.0880 1.4970 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0
  7919. 2.2530 -0.4520 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0
  7920. 2.4000 -1.2010 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  7921. 2.5920 -1.1210 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0
  7922. 1.9660 -2.0020 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0
  7923. 2.4440 -0.4330 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0
  7924. 3.6350 -1.4510 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0
  7925. 0.7910 0.0130 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0
  7926. 0.5880 0.5160 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  7927. 0.5990 0.7050 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
  7928. -0.0660 -1.1370 0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0
  7929. -1.4300 -1.0550 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0
  7930. -2.1060 -2.0780 0.2450 O 0 0 0 0 0 0 0 0 0 0 0 0
  7931. -2.0570 0.3330 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
  7932. -1.4370 1.0790 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0
  7933. -3.4120 0.3570 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0
  7934. -3.3060 0.0610 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
  7935. -3.8480 1.3610 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0
  7936. -4.1260 -0.3310 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0
  7937. -2.2170 0.6930 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0
  7938. -1.2550 0.6780 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0
  7939. -2.8740 -0.0170 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0
  7940. -2.6460 1.6940 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
  7941. 1 2 1 0 0 0 0
  7942. 1 3 1 0 0 0 0
  7943. 1 4 1 0 0 0 0
  7944. 1 5 1 0 0 0 0
  7945. 5 6 1 0 0 0 0
  7946. 5 7 1 0 0 0 0
  7947. 5 11 1 0 0 0 0
  7948. 7 8 1 0 0 0 0
  7949. 7 9 1 0 0 0 0
  7950. 7 10 1 0 0 0 0
  7951. 11 12 1 0 0 0 0
  7952. 11 13 1 0 0 0 0
  7953. 11 14 1 0 0 0 0
  7954. 14 15 1 0 0 0 0
  7955. 15 16 2 0 0 0 0
  7956. 15 17 1 0 0 0 0
  7957. 17 18 1 0 0 0 0
  7958. 17 19 1 0 0 0 0
  7959. 17 23 1 0 0 0 0
  7960. 19 20 1 0 0 0 0
  7961. 19 21 1 0 0 0 0
  7962. 19 22 1 0 0 0 0
  7963. 23 24 1 0 0 0 0
  7964. 23 25 1 0 0 0 0
  7965. 23 26 1 0 0 0 0
  7966. M END
  7967. $$$$
  7968. dan241.sdf
  7969. MOE2004 3D
  7970. 27 26 0 0 1 0 0 0 0 0999 V2000
  7971. -3.0620 0.4930 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0
  7972. -3.7820 0.5420 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0
  7973. -3.3200 1.2760 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0
  7974. -3.1790 -0.4710 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0
  7975. -1.6390 0.6920 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0
  7976. -0.9600 0.6200 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0
  7977. -1.5450 1.7120 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0
  7978. -1.2340 -0.3030 0.8520 C 0 0 3 0 0 0 0 0 0 0 0 0
  7979. -1.2840 -1.7680 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0
  7980. -0.8040 -2.4130 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0
  7981. -2.3170 -2.1060 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0
  7982. -0.7770 -1.9320 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0
  7983. 0.0000 0.0020 1.5320 O 0 0 0 0 0 0 0 0 0 0 0 0
  7984. 1.2350 0.3050 0.8510 C 0 0 3 0 0 0 0 0 0 0 0 0
  7985. 1.2840 1.7700 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0
  7986. 0.8060 2.4150 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0
  7987. 2.3170 2.1070 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0
  7988. 0.7750 1.9330 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0
  7989. 1.6380 -0.6910 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0
  7990. 0.9610 -0.6170 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
  7991. 1.5410 -1.7110 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  7992. 3.0630 -0.4960 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0
  7993. 3.1840 0.4690 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0
  7994. 3.7810 -0.5510 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0
  7995. 3.3180 -1.2780 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
  7996. -1.9830 -0.2100 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0
  7997. 1.9840 0.2130 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0
  7998. 1 2 1 0 0 0 0
  7999. 1 3 1 0 0 0 0
  8000. 1 4 1 0 0 0 0
  8001. 1 5 1 0 0 0 0
  8002. 5 6 1 0 0 0 0
  8003. 5 7 1 0 0 0 0
  8004. 5 8 1 0 0 0 0
  8005. 8 9 1 0 0 0 0
  8006. 8 13 1 0 0 0 0
  8007. 8 26 1 0 0 0 0
  8008. 9 10 1 0 0 0 0
  8009. 9 11 1 0 0 0 0
  8010. 9 12 1 0 0 0 0
  8011. 13 14 1 0 0 0 0
  8012. 14 15 1 0 0 0 0
  8013. 14 19 1 0 0 0 0
  8014. 14 27 1 0 0 0 0
  8015. 15 16 1 0 0 0 0
  8016. 15 17 1 0 0 0 0
  8017. 15 18 1 0 0 0 0
  8018. 19 20 1 0 0 0 0
  8019. 19 21 1 0 0 0 0
  8020. 19 22 1 0 0 0 0
  8021. 22 23 1 0 0 0 0
  8022. 22 24 1 0 0 0 0
  8023. 22 25 1 0 0 0 0
  8024. M END
  8025. $$$$
  8026. dan242.sdf
  8027. MOE2004 3D
  8028. 27 26 0 0 1 0 0 0 0 0999 V2000
  8029. -1.4970 1.4010 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0
  8030. -1.1550 1.2990 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0
  8031. -1.0240 2.2940 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0
  8032. -1.1590 0.1490 -0.5830 C 0 0 3 0 0 0 0 0 0 0 0 0
  8033. 0.3270 0.1490 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  8034. 0.5180 1.0450 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0
  8035. 0.5050 -0.7040 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0
  8036. 1.3390 0.1010 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0
  8037. 1.1930 -0.8100 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0
  8038. 1.1850 0.9500 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0
  8039. 2.7750 0.1310 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0
  8040. 2.9410 1.0450 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0
  8041. 2.9430 -0.7150 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
  8042. 3.7870 0.0700 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0
  8043. 4.8050 0.0940 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8044. 3.6690 0.9200 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
  8045. 3.6730 -0.8510 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  8046. -1.5310 -1.1680 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0
  8047. -1.0550 -1.2160 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0
  8048. -1.1370 -2.0120 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
  8049. -3.0270 -1.3890 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0
  8050. -3.4530 -0.6980 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0
  8051. -3.5610 -1.2690 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0
  8052. -3.2160 -2.4030 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0
  8053. -2.8990 1.6420 0.2760 O 0 0 0 0 0 0 0 0 0 0 0 0
  8054. -3.1960 1.7540 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0
  8055. -1.7500 0.1880 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0
  8056. 1 2 1 0 0 0 0
  8057. 1 3 1 0 0 0 0
  8058. 1 4 1 0 0 0 0
  8059. 1 25 1 0 0 0 0
  8060. 4 5 1 0 0 0 0
  8061. 4 18 1 0 0 0 0
  8062. 4 27 1 0 0 0 0
  8063. 5 6 1 0 0 0 0
  8064. 5 7 1 0 0 0 0
  8065. 5 8 1 0 0 0 0
  8066. 8 9 1 0 0 0 0
  8067. 8 10 1 0 0 0 0
  8068. 8 11 1 0 0 0 0
  8069. 11 12 1 0 0 0 0
  8070. 11 13 1 0 0 0 0
  8071. 11 14 1 0 0 0 0
  8072. 14 15 1 0 0 0 0
  8073. 14 16 1 0 0 0 0
  8074. 14 17 1 0 0 0 0
  8075. 18 19 1 0 0 0 0
  8076. 18 20 1 0 0 0 0
  8077. 18 21 1 0 0 0 0
  8078. 21 22 1 0 0 0 0
  8079. 21 23 1 0 0 0 0
  8080. 21 24 1 0 0 0 0
  8081. 25 26 1 0 0 0 0
  8082. M END
  8083. $$$$
  8084. dan243.sdf
  8085. MOE2004 3D
  8086. 27 26 0 0 0 0 0 0 0 0999 V2000
  8087. 3.3760 -0.6740 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0
  8088. 3.0650 -1.7180 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  8089. 4.0110 -0.6060 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0
  8090. 2.1660 0.2450 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0
  8091. 1.6480 -0.0010 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0
  8092. 2.5050 1.2840 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0
  8093. 1.2060 0.1190 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0
  8094. 1.7500 0.3240 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0
  8095. 0.8500 -0.9140 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0
  8096. 0.0160 1.0820 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0
  8097. 0.3940 2.1110 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0
  8098. -0.5790 0.9670 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0
  8099. -0.8970 0.9290 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0
  8100. -0.3430 1.2110 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0
  8101. -1.7070 1.6620 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0
  8102. -1.4930 -0.4670 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0
  8103. -0.6900 -1.1760 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0
  8104. -2.1250 -0.4370 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0
  8105. -2.3170 -1.0210 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0
  8106. -1.6910 -1.1390 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
  8107. -2.6620 -2.0260 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0
  8108. -3.5320 -0.1710 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0
  8109. -3.2400 0.8090 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0
  8110. -4.1670 -0.0200 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0
  8111. -4.1320 -0.6650 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
  8112. 4.1600 -0.3200 0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0
  8113. 4.4260 0.6090 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0
  8114. 1 2 1 0 0 0 0
  8115. 1 3 1 0 0 0 0
  8116. 1 4 1 0 0 0 0
  8117. 1 26 1 0 0 0 0
  8118. 4 5 1 0 0 0 0
  8119. 4 6 1 0 0 0 0
  8120. 4 7 1 0 0 0 0
  8121. 7 8 1 0 0 0 0
  8122. 7 9 1 0 0 0 0
  8123. 7 10 1 0 0 0 0
  8124. 10 11 1 0 0 0 0
  8125. 10 12 1 0 0 0 0
  8126. 10 13 1 0 0 0 0
  8127. 13 14 1 0 0 0 0
  8128. 13 15 1 0 0 0 0
  8129. 13 16 1 0 0 0 0
  8130. 16 17 1 0 0 0 0
  8131. 16 18 1 0 0 0 0
  8132. 16 19 1 0 0 0 0
  8133. 19 20 1 0 0 0 0
  8134. 19 21 1 0 0 0 0
  8135. 19 22 1 0 0 0 0
  8136. 22 23 1 0 0 0 0
  8137. 22 24 1 0 0 0 0
  8138. 22 25 1 0 0 0 0
  8139. 26 27 1 0 0 0 0
  8140. M END
  8141. $$$$
  8142. dan244.sdf
  8143. MOE2004 3D
  8144. 27 26 0 0 1 0 0 0 0 0999 V2000
  8145. -4.2920 -0.7010 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  8146. -4.3940 -0.8680 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
  8147. -4.2220 -1.6720 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0
  8148. -5.2130 -0.2080 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0
  8149. -3.0820 0.1720 0.3020 C 0 0 3 0 0 0 0 0 0 0 0 0
  8150. -1.7860 -0.4940 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0
  8151. -1.8140 -0.6090 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0
  8152. -1.7130 -1.4990 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8153. -0.5340 0.3070 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0
  8154. -0.5200 0.4840 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0
  8155. -0.5580 1.2880 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0
  8156. 0.7420 -0.4280 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0
  8157. 0.7250 -0.6130 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
  8158. 0.7790 -1.4070 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0
  8159. 1.9920 0.3750 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0
  8160. 2.0100 0.5600 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  8161. 1.9550 1.3540 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0
  8162. 3.2680 -0.3570 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0
  8163. 3.2580 -0.5430 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0
  8164. 3.3150 -1.3340 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  8165. 4.5110 0.4410 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
  8166. 5.4120 -0.1000 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0
  8167. 4.5130 1.4120 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0
  8168. 4.5710 0.6170 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0
  8169. -3.2720 1.4210 -0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0
  8170. -2.6080 2.0420 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0
  8171. -3.0420 0.3590 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0
  8172. 1 2 1 0 0 0 0
  8173. 1 3 1 0 0 0 0
  8174. 1 4 1 0 0 0 0
  8175. 1 5 1 0 0 0 0
  8176. 5 6 1 0 0 0 0
  8177. 5 25 1 0 0 0 0
  8178. 5 27 1 0 0 0 0
  8179. 6 7 1 0 0 0 0
  8180. 6 8 1 0 0 0 0
  8181. 6 9 1 0 0 0 0
  8182. 9 10 1 0 0 0 0
  8183. 9 11 1 0 0 0 0
  8184. 9 12 1 0 0 0 0
  8185. 12 13 1 0 0 0 0
  8186. 12 14 1 0 0 0 0
  8187. 12 15 1 0 0 0 0
  8188. 15 16 1 0 0 0 0
  8189. 15 17 1 0 0 0 0
  8190. 15 18 1 0 0 0 0
  8191. 18 19 1 0 0 0 0
  8192. 18 20 1 0 0 0 0
  8193. 18 21 1 0 0 0 0
  8194. 21 22 1 0 0 0 0
  8195. 21 23 1 0 0 0 0
  8196. 21 24 1 0 0 0 0
  8197. 25 26 1 0 0 0 0
  8198. M END
  8199. $$$$
  8200. dan245.sdf
  8201. MOE2004 3D
  8202. 27 26 0 0 0 0 0 0 0 0999 V2000
  8203. -3.4700 -0.8300 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0
  8204. -3.9780 -0.3450 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0
  8205. -4.2350 -1.2400 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  8206. -2.8860 -1.6700 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0
  8207. -2.5930 0.1580 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0
  8208. -2.0850 -0.3580 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0
  8209. -3.2400 0.9100 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0
  8210. -1.5780 0.8810 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0
  8211. -1.0390 1.6160 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0
  8212. -2.1210 1.4630 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0
  8213. -0.5700 -0.0210 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  8214. 0.0880 0.6110 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0
  8215. -1.1020 -0.6560 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0
  8216. 0.2810 -0.9210 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0
  8217. 0.9390 -1.5260 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0
  8218. -0.3680 -1.6400 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0
  8219. 1.1230 -0.1910 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0
  8220. 1.6750 -0.9400 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0
  8221. 0.4560 0.2950 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0
  8222. 2.0990 0.8640 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0
  8223. 2.6390 1.3050 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
  8224. 1.5260 1.6880 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0
  8225. 3.1080 0.3770 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0
  8226. 3.7130 1.2240 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0
  8227. 2.6010 -0.0250 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0
  8228. 4.2480 -0.8870 -0.0130 S 0 0 0 0 0 0 0 0 0 0 0 0
  8229. 4.7710 -0.1410 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0
  8230. 1 2 1 0 0 0 0
  8231. 1 3 1 0 0 0 0
  8232. 1 4 1 0 0 0 0
  8233. 1 5 1 0 0 0 0
  8234. 5 6 1 0 0 0 0
  8235. 5 7 1 0 0 0 0
  8236. 5 8 1 0 0 0 0
  8237. 8 9 1 0 0 0 0
  8238. 8 10 1 0 0 0 0
  8239. 8 11 1 0 0 0 0
  8240. 11 12 1 0 0 0 0
  8241. 11 13 1 0 0 0 0
  8242. 11 14 1 0 0 0 0
  8243. 14 15 1 0 0 0 0
  8244. 14 16 1 0 0 0 0
  8245. 14 17 1 0 0 0 0
  8246. 17 18 1 0 0 0 0
  8247. 17 19 1 0 0 0 0
  8248. 17 20 1 0 0 0 0
  8249. 20 21 1 0 0 0 0
  8250. 20 22 1 0 0 0 0
  8251. 20 23 1 0 0 0 0
  8252. 23 24 1 0 0 0 0
  8253. 23 25 1 0 0 0 0
  8254. 23 26 1 0 0 0 0
  8255. 26 27 1 0 0 0 0
  8256. M END
  8257. $$$$
  8258. dan246.sdf
  8259. MOE2004 3D
  8260. 21 21 0 0 0 0 0 0 0 0999 V2000
  8261. -0.7930 0.2900 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0
  8262. -1.6970 1.3470 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0
  8263. -1.3460 2.3760 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0
  8264. -3.0620 1.0890 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0
  8265. -3.7590 1.9110 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0
  8266. -3.5310 -0.2220 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0
  8267. -4.5940 -0.4220 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0
  8268. -2.6370 -1.2770 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0
  8269. -3.0050 -2.2990 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0
  8270. -1.2700 -1.0240 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0
  8271. -0.5960 -1.8650 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0
  8272. 0.6320 0.6140 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0
  8273. 1.0590 1.7600 0.3390 O 0 0 0 0 0 0 0 0 0 0 0 0
  8274. 1.3790 -0.5190 0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0
  8275. 2.7970 -0.3320 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0
  8276. 3.1950 -1.2130 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0
  8277. 3.0310 0.5360 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  8278. 3.4330 -0.2100 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0
  8279. 4.5200 -0.1250 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0
  8280. 3.1920 -1.0830 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0
  8281. 3.0540 0.6680 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0
  8282. 1 2 2 0 0 0 0
  8283. 1 10 1 0 0 0 0
  8284. 1 12 1 0 0 0 0
  8285. 2 3 1 0 0 0 0
  8286. 2 4 1 0 0 0 0
  8287. 4 5 1 0 0 0 0
  8288. 4 6 2 0 0 0 0
  8289. 6 7 1 0 0 0 0
  8290. 6 8 1 0 0 0 0
  8291. 8 9 1 0 0 0 0
  8292. 8 10 2 0 0 0 0
  8293. 10 11 1 0 0 0 0
  8294. 12 13 2 0 0 0 0
  8295. 12 14 1 0 0 0 0
  8296. 14 15 1 0 0 0 0
  8297. 15 16 1 0 0 0 0
  8298. 15 17 1 0 0 0 0
  8299. 15 18 1 0 0 0 0
  8300. 18 19 1 0 0 0 0
  8301. 18 20 1 0 0 0 0
  8302. 18 21 1 0 0 0 0
  8303. M END
  8304. $$$$
  8305. dan247.sdf
  8306. MOE2004 3D
  8307. 22 22 0 0 0 0 0 0 0 0999 V2000
  8308. -2.8670 1.2420 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0
  8309. -3.3490 2.2040 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8310. -3.5500 0.0670 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0
  8311. -4.5660 0.1110 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
  8312. -2.9270 -1.1660 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0
  8313. -3.4560 -2.0830 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0
  8314. -1.6200 -1.2250 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0
  8315. -1.1430 -2.1940 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8316. -0.9260 -0.0490 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0
  8317. -1.5600 1.1860 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0
  8318. -1.0350 2.1120 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
  8319. 0.4880 -0.1080 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0
  8320. 0.6650 -1.0540 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0
  8321. 0.6660 0.7080 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0
  8322. 1.3810 0.0080 0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0
  8323. 2.7490 -0.0370 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0
  8324. 2.9540 0.7870 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0
  8325. 2.9520 -0.9880 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0
  8326. 3.6240 0.0940 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0
  8327. 3.4210 1.0350 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
  8328. 3.4160 -0.7140 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0
  8329. 4.6840 0.0620 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0
  8330. 1 2 1 0 0 0 0
  8331. 1 3 1 0 0 0 0
  8332. 1 10 2 0 0 0 0
  8333. 3 4 1 0 0 0 0
  8334. 3 5 2 0 0 0 0
  8335. 5 6 1 0 0 0 0
  8336. 5 7 1 0 0 0 0
  8337. 7 8 1 0 0 0 0
  8338. 7 9 2 0 0 0 0
  8339. 9 10 1 0 0 0 0
  8340. 9 12 1 0 0 0 0
  8341. 10 11 1 0 0 0 0
  8342. 12 13 1 0 0 0 0
  8343. 12 14 1 0 0 0 0
  8344. 12 15 1 0 0 0 0
  8345. 15 16 1 0 0 0 0
  8346. 16 17 1 0 0 0 0
  8347. 16 18 1 0 0 0 0
  8348. 16 19 1 0 0 0 0
  8349. 19 20 1 0 0 0 0
  8350. 19 21 1 0 0 0 0
  8351. 19 22 1 0 0 0 0
  8352. M END
  8353. $$$$
  8354. dan248.sdf
  8355. MOE2004 3D
  8356. 24 24 0 0 0 0 0 0 0 0999 V2000
  8357. 1.0000 -0.1600 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
  8358. 0.5210 -1.5290 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0
  8359. 1.1760 -2.3260 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0
  8360. 0.5490 -1.5640 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0
  8361. -0.8970 -1.8480 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  8362. -1.8520 -0.7350 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0
  8363. -2.8780 -1.0160 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0
  8364. -1.4630 0.5380 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0
  8365. -0.0350 0.9280 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0
  8366. 0.0330 1.1680 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8367. 0.2100 1.8520 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0
  8368. -2.4430 1.6700 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  8369. -3.4630 1.3190 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0
  8370. -2.4560 2.2530 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0
  8371. -2.1660 2.3350 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0
  8372. 2.3520 0.1840 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0
  8373. 2.2710 0.2290 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0
  8374. 3.1120 -0.5660 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0
  8375. 2.7220 1.1560 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0
  8376. 1.2040 -0.2130 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0
  8377. 1.9450 -0.9720 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0
  8378. 0.2820 -0.4500 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  8379. 1.5650 0.7480 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
  8380. -1.2880 -3.0010 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0
  8381. 1 2 1 0 0 0 0
  8382. 1 9 1 0 0 0 0
  8383. 1 16 1 0 0 0 0
  8384. 1 20 1 0 0 0 0
  8385. 2 3 1 0 0 0 0
  8386. 2 4 1 0 0 0 0
  8387. 2 5 1 0 0 0 0
  8388. 5 6 1 0 0 0 0
  8389. 5 24 2 0 0 0 0
  8390. 6 7 1 0 0 0 0
  8391. 6 8 2 0 0 0 0
  8392. 8 9 1 0 0 0 0
  8393. 8 12 1 0 0 0 0
  8394. 9 10 1 0 0 0 0
  8395. 9 11 1 0 0 0 0
  8396. 12 13 1 0 0 0 0
  8397. 12 14 1 0 0 0 0
  8398. 12 15 1 0 0 0 0
  8399. 16 17 1 0 0 0 0
  8400. 16 18 1 0 0 0 0
  8401. 16 19 1 0 0 0 0
  8402. 20 21 1 0 0 0 0
  8403. 20 22 1 0 0 0 0
  8404. 20 23 1 0 0 0 0
  8405. M END
  8406. $$$$
  8407. dan249.sdf
  8408. MOE2004 3D
  8409. 28 27 0 0 0 0 0 0 0 0999 V2000
  8410. -2.1270 0.0160 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0
  8411. -1.3420 -0.6400 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0
  8412. -1.8160 1.0510 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0
  8413. -3.0280 -0.1670 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0
  8414. -2.3940 -0.2460 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
  8415. -2.7000 -1.2920 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0
  8416. -3.5470 0.6350 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0
  8417. -3.7790 0.4300 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0
  8418. -4.4540 0.4470 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8419. -3.3020 1.6980 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  8420. -1.1370 0.0140 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0
  8421. -1.3850 -0.0190 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0
  8422. -0.7460 1.0150 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0
  8423. -0.0340 -1.0090 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0
  8424. -0.2580 -2.1360 -0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0
  8425. 1.3730 -0.5920 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0
  8426. 1.3100 -0.0340 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0
  8427. 1.9560 -1.4950 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8428. 2.0470 0.2490 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0
  8429. 1.3760 1.0610 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0
  8430. 3.3320 0.8790 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0
  8431. 3.1210 1.5220 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0
  8432. 3.8160 1.4960 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
  8433. 4.0490 0.1140 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0
  8434. 2.3570 -0.5900 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0
  8435. 2.8540 0.0170 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0
  8436. 1.4430 -0.9930 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0
  8437. 3.0160 -1.4310 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  8438. 1 2 1 0 0 0 0
  8439. 1 3 1 0 0 0 0
  8440. 1 4 1 0 0 0 0
  8441. 1 5 1 0 0 0 0
  8442. 5 6 1 0 0 0 0
  8443. 5 7 1 0 0 0 0
  8444. 5 11 1 0 0 0 0
  8445. 7 8 1 0 0 0 0
  8446. 7 9 1 0 0 0 0
  8447. 7 10 1 0 0 0 0
  8448. 11 12 1 0 0 0 0
  8449. 11 13 1 0 0 0 0
  8450. 11 14 1 0 0 0 0
  8451. 14 15 2 0 0 0 0
  8452. 14 16 1 0 0 0 0
  8453. 16 17 1 0 0 0 0
  8454. 16 18 1 0 0 0 0
  8455. 16 19 1 0 0 0 0
  8456. 19 20 1 0 0 0 0
  8457. 19 21 1 0 0 0 0
  8458. 19 25 1 0 0 0 0
  8459. 21 22 1 0 0 0 0
  8460. 21 23 1 0 0 0 0
  8461. 21 24 1 0 0 0 0
  8462. 25 26 1 0 0 0 0
  8463. 25 27 1 0 0 0 0
  8464. 25 28 1 0 0 0 0
  8465. M END
  8466. $$$$
  8467. dan250.sdf
  8468. MOE2004 3D
  8469. 28 27 0 0 0 0 0 0 0 0999 V2000
  8470. 4.5420 -0.2560 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0
  8471. 4.9140 0.4010 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0
  8472. 4.6630 -1.2930 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  8473. 5.1680 -0.1050 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0
  8474. 3.0880 0.0470 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0
  8475. 3.0070 1.0820 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0
  8476. 2.7730 -0.5990 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8477. 2.1850 -0.1630 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0
  8478. 2.2250 -1.2120 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0
  8479. 2.5720 0.4290 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0
  8480. 0.7280 0.2470 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0
  8481. 0.2070 0.2010 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0
  8482. 0.6900 1.2920 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0
  8483. 0.0020 -0.6420 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0
  8484. 0.5240 -0.6070 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0
  8485. 0.0290 -1.6850 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0
  8486. -1.4490 -0.2190 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0
  8487. -1.4740 0.8190 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0
  8488. -1.8530 -0.8260 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0
  8489. -2.3470 -0.3720 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0
  8490. -2.2280 -1.3680 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0
  8491. -2.0980 0.3560 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
  8492. -3.8060 -0.1970 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0
  8493. -4.5670 -1.1570 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0
  8494. -4.2810 1.2000 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0
  8495. -5.3710 1.2060 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0
  8496. -4.0000 1.8720 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0
  8497. -3.8450 1.5460 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  8498. 1 2 1 0 0 0 0
  8499. 1 3 1 0 0 0 0
  8500. 1 4 1 0 0 0 0
  8501. 1 5 1 0 0 0 0
  8502. 5 6 1 0 0 0 0
  8503. 5 7 1 0 0 0 0
  8504. 5 8 1 0 0 0 0
  8505. 8 9 1 0 0 0 0
  8506. 8 10 1 0 0 0 0
  8507. 8 11 1 0 0 0 0
  8508. 11 12 1 0 0 0 0
  8509. 11 13 1 0 0 0 0
  8510. 11 14 1 0 0 0 0
  8511. 14 15 1 0 0 0 0
  8512. 14 16 1 0 0 0 0
  8513. 14 17 1 0 0 0 0
  8514. 17 18 1 0 0 0 0
  8515. 17 19 1 0 0 0 0
  8516. 17 20 1 0 0 0 0
  8517. 20 21 1 0 0 0 0
  8518. 20 22 1 0 0 0 0
  8519. 20 23 1 0 0 0 0
  8520. 23 24 2 0 0 0 0
  8521. 23 25 1 0 0 0 0
  8522. 25 26 1 0 0 0 0
  8523. 25 27 1 0 0 0 0
  8524. 25 28 1 0 0 0 0
  8525. M END
  8526. $$$$
  8527. dan251.sdf
  8528. MOE2004 3D
  8529. 28 27 0 0 0 0 0 0 0 0999 V2000
  8530. -4.1370 0.5510 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0
  8531. -3.8050 1.2830 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0
  8532. -4.9400 -0.0430 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0
  8533. -4.5530 1.0950 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0
  8534. -2.9900 -0.3500 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0
  8535. -3.3650 -1.0890 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0
  8536. -2.6300 -0.9040 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0
  8537. -1.8490 0.4540 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0
  8538. -1.4750 1.1900 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0
  8539. -2.2380 1.0240 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0
  8540. -0.7080 -0.4340 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0
  8541. 0.0350 0.1670 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0
  8542. -1.0930 -1.1610 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0
  8543. -0.0010 -1.1980 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  8544. 0.7030 -0.4190 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
  8545. -0.0410 0.1890 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0
  8546. 1.0850 -1.1360 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0
  8547. 1.8450 0.4620 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0
  8548. 1.4750 1.1810 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  8549. 2.2240 1.0510 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0
  8550. 2.9950 -0.3510 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  8551. 3.3650 -1.0720 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0
  8552. 2.6440 -0.9250 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0
  8553. 4.1420 0.5460 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0
  8554. 4.5450 1.1110 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
  8555. 3.8140 1.2580 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0
  8556. 4.9530 -0.0540 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0
  8557. 0.0010 -2.4260 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0
  8558. 1 2 1 0 0 0 0
  8559. 1 3 1 0 0 0 0
  8560. 1 4 1 0 0 0 0
  8561. 1 5 1 0 0 0 0
  8562. 5 6 1 0 0 0 0
  8563. 5 7 1 0 0 0 0
  8564. 5 8 1 0 0 0 0
  8565. 8 9 1 0 0 0 0
  8566. 8 10 1 0 0 0 0
  8567. 8 11 1 0 0 0 0
  8568. 11 12 1 0 0 0 0
  8569. 11 13 1 0 0 0 0
  8570. 11 14 1 0 0 0 0
  8571. 14 15 1 0 0 0 0
  8572. 14 28 2 0 0 0 0
  8573. 15 16 1 0 0 0 0
  8574. 15 17 1 0 0 0 0
  8575. 15 18 1 0 0 0 0
  8576. 18 19 1 0 0 0 0
  8577. 18 20 1 0 0 0 0
  8578. 18 21 1 0 0 0 0
  8579. 21 22 1 0 0 0 0
  8580. 21 23 1 0 0 0 0
  8581. 21 24 1 0 0 0 0
  8582. 24 25 1 0 0 0 0
  8583. 24 26 1 0 0 0 0
  8584. 24 27 1 0 0 0 0
  8585. M END
  8586. $$$$
  8587. dan252.sdf
  8588. MOE2004 3D
  8589. 29 28 0 0 0 0 0 0 0 0999 V2000
  8590. 4.8910 -0.5160 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0
  8591. 5.3730 0.4200 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0
  8592. 5.4880 -0.9610 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0
  8593. 4.9090 -1.2000 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0
  8594. 3.4670 -0.2710 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0
  8595. 3.0410 -1.2240 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0
  8596. 3.4890 0.3920 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
  8597. 2.6070 0.3470 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0
  8598. 3.0990 1.2550 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0
  8599. 2.5450 -0.3410 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0
  8600. 1.1950 0.7240 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0
  8601. 1.2560 1.4030 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0
  8602. 0.7220 1.2870 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0
  8603. 0.3260 -0.4870 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0
  8604. 0.2690 -1.1690 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0
  8605. 0.7960 -1.0470 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0
  8606. -1.0870 -0.1100 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0
  8607. -1.5870 -1.0110 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0
  8608. -1.0430 0.5740 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0
  8609. -1.9410 0.5110 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0
  8610. -1.5320 1.4790 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0
  8611. -1.9670 -0.1200 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0
  8612. -3.2670 0.7680 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0
  8613. -4.1590 -0.2610 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
  8614. -3.9240 -1.3680 -0.6030 O 0 0 0 0 0 0 0 0 0 0 0 0
  8615. -5.4930 0.1610 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0
  8616. -5.4030 0.4060 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0
  8617. -5.8660 1.0210 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0
  8618. -6.2050 -0.6620 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
  8619. 1 2 1 0 0 0 0
  8620. 1 3 1 0 0 0 0
  8621. 1 4 1 0 0 0 0
  8622. 1 5 1 0 0 0 0
  8623. 5 6 1 0 0 0 0
  8624. 5 7 1 0 0 0 0
  8625. 5 8 1 0 0 0 0
  8626. 8 9 1 0 0 0 0
  8627. 8 10 1 0 0 0 0
  8628. 8 11 1 0 0 0 0
  8629. 11 12 1 0 0 0 0
  8630. 11 13 1 0 0 0 0
  8631. 11 14 1 0 0 0 0
  8632. 14 15 1 0 0 0 0
  8633. 14 16 1 0 0 0 0
  8634. 14 17 1 0 0 0 0
  8635. 17 18 1 0 0 0 0
  8636. 17 19 1 0 0 0 0
  8637. 17 20 1 0 0 0 0
  8638. 20 21 1 0 0 0 0
  8639. 20 22 1 0 0 0 0
  8640. 20 23 1 0 0 0 0
  8641. 23 24 1 0 0 0 0
  8642. 24 25 2 0 0 0 0
  8643. 24 26 1 0 0 0 0
  8644. 26 27 1 0 0 0 0
  8645. 26 28 1 0 0 0 0
  8646. 26 29 1 0 0 0 0
  8647. M END
  8648. $$$$
  8649. dan253.sdf
  8650. MOE2004 3D
  8651. 29 28 0 0 0 0 0 0 0 0999 V2000
  8652. 4.6440 -0.5360 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0
  8653. 4.6590 -0.4120 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0
  8654. 5.1680 0.3120 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0
  8655. 5.2000 -1.4460 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
  8656. 3.2170 -0.6340 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0
  8657. 2.7460 -1.5180 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0
  8658. 3.2390 -0.7870 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0
  8659. 2.4140 0.6240 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0
  8660. 2.9500 1.5000 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0
  8661. 2.3530 0.7480 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0
  8662. 1.0040 0.6310 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0
  8663. 1.0640 0.4900 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  8664. 0.5810 1.6270 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0
  8665. 0.0760 -0.4260 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0
  8666. 0.0150 -0.2850 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
  8667. 0.5000 -1.4220 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8668. -1.3350 -0.4200 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0
  8669. -1.8640 -1.3000 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0
  8670. -1.2730 -0.5420 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8671. -2.1390 0.8410 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0
  8672. -1.6430 1.7190 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  8673. -2.1660 0.9820 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  8674. -3.5620 0.7920 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0
  8675. -3.5610 0.5640 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0
  8676. -4.0360 1.7750 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  8677. -4.4290 -0.1890 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0
  8678. -4.8430 0.0020 -1.3900 O 0 0 0 0 0 0 0 0 0 0 0 0
  8679. -4.6910 -1.3250 0.4370 O 0 0 0 0 0 0 0 0 0 0 0 0
  8680. -4.2870 -1.3670 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0
  8681. 1 2 1 0 0 0 0
  8682. 1 3 1 0 0 0 0
  8683. 1 4 1 0 0 0 0
  8684. 1 5 1 0 0 0 0
  8685. 5 6 1 0 0 0 0
  8686. 5 7 1 0 0 0 0
  8687. 5 8 1 0 0 0 0
  8688. 8 9 1 0 0 0 0
  8689. 8 10 1 0 0 0 0
  8690. 8 11 1 0 0 0 0
  8691. 11 12 1 0 0 0 0
  8692. 11 13 1 0 0 0 0
  8693. 11 14 1 0 0 0 0
  8694. 14 15 1 0 0 0 0
  8695. 14 16 1 0 0 0 0
  8696. 14 17 1 0 0 0 0
  8697. 17 18 1 0 0 0 0
  8698. 17 19 1 0 0 0 0
  8699. 17 20 1 0 0 0 0
  8700. 20 21 1 0 0 0 0
  8701. 20 22 1 0 0 0 0
  8702. 20 23 1 0 0 0 0
  8703. 23 24 1 0 0 0 0
  8704. 23 25 1 0 0 0 0
  8705. 23 26 1 0 0 0 0
  8706. 26 27 2 0 0 0 0
  8707. 26 28 1 0 0 0 0
  8708. 28 29 1 0 0 0 0
  8709. M END
  8710. $$$$
  8711. dan254.sdf
  8712. MOE2004 3D
  8713. 29 28 0 0 0 0 0 0 0 0999 V2000
  8714. -3.7170 -1.3150 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0
  8715. -4.1150 -0.8730 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0
  8716. -2.7700 -1.8080 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0
  8717. -4.4170 -2.0870 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8718. -3.5440 -0.2610 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0
  8719. -4.5360 0.1080 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0
  8720. -3.1220 -0.7260 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  8721. -2.6930 0.9360 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0
  8722. -3.2090 1.4560 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8723. -2.6450 1.6480 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  8724. -1.2670 0.6140 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0
  8725. -1.2960 -0.0190 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0
  8726. -0.8030 1.5560 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0
  8727. -0.4090 -0.0510 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0
  8728. -0.3740 0.5870 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
  8729. -0.8750 -0.9930 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0
  8730. 1.0160 -0.3700 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
  8731. 1.4910 -0.9840 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0
  8732. 0.9790 -0.9860 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0
  8733. 1.8730 0.8760 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0
  8734. 1.4360 1.4790 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8735. 1.8870 1.4900 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0
  8736. 3.3050 0.5210 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0
  8737. 3.3060 -0.1270 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0
  8738. 3.8550 1.4400 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0
  8739. 3.9450 -0.1480 0.6530 O 0 0 0 0 0 0 0 0 0 0 0 0
  8740. 5.2240 -0.5410 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0
  8741. 5.6250 -1.0430 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
  8742. 5.8510 -0.3790 -0.6350 O 0 0 0 0 0 0 0 0 0 0 0 0
  8743. 1 2 1 0 0 0 0
  8744. 1 3 1 0 0 0 0
  8745. 1 4 1 0 0 0 0
  8746. 1 5 1 0 0 0 0
  8747. 5 6 1 0 0 0 0
  8748. 5 7 1 0 0 0 0
  8749. 5 8 1 0 0 0 0
  8750. 8 9 1 0 0 0 0
  8751. 8 10 1 0 0 0 0
  8752. 8 11 1 0 0 0 0
  8753. 11 12 1 0 0 0 0
  8754. 11 13 1 0 0 0 0
  8755. 11 14 1 0 0 0 0
  8756. 14 15 1 0 0 0 0
  8757. 14 16 1 0 0 0 0
  8758. 14 17 1 0 0 0 0
  8759. 17 18 1 0 0 0 0
  8760. 17 19 1 0 0 0 0
  8761. 17 20 1 0 0 0 0
  8762. 20 21 1 0 0 0 0
  8763. 20 22 1 0 0 0 0
  8764. 20 23 1 0 0 0 0
  8765. 23 24 1 0 0 0 0
  8766. 23 25 1 0 0 0 0
  8767. 23 26 1 0 0 0 0
  8768. 26 27 1 0 0 0 0
  8769. 27 28 1 0 0 0 0
  8770. 27 29 2 0 0 0 0
  8771. M END
  8772. $$$$
  8773. dan255.sdf
  8774. MOE2004 3D
  8775. 30 29 0 0 0 0 0 0 0 0999 V2000
  8776. -3.3330 -0.7270 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0
  8777. -3.2210 -1.5250 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0
  8778. -4.3660 -0.3680 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
  8779. -3.1960 -1.1570 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0
  8780. -2.3570 0.4190 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0
  8781. -2.6840 0.8920 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0
  8782. -2.4610 1.4790 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0
  8783. -3.4700 1.9020 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0
  8784. -1.7620 2.3020 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
  8785. -2.2480 1.0640 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0
  8786. -0.9020 -0.0460 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0
  8787. -0.3440 0.8220 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0
  8788. -0.9100 -0.7770 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0
  8789. -0.1580 -0.6520 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0
  8790. -0.1920 0.0310 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
  8791. 1.3100 -1.0050 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  8792. 1.7320 -1.5020 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0
  8793. 1.3310 -1.7710 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8794. 2.2270 0.1630 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
  8795. 1.8720 0.5840 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0
  8796. 2.2560 1.2840 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0
  8797. 1.2780 1.7650 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0
  8798. 2.9700 2.0640 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0
  8799. 2.5490 0.9060 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0
  8800. 3.6470 -0.3560 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0
  8801. 3.6520 -1.1320 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
  8802. 4.0770 -0.7830 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
  8803. 4.3060 0.4500 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0
  8804. -0.8010 -1.8560 -0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0
  8805. -0.8020 -2.4720 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0
  8806. 1 2 1 0 0 0 0
  8807. 1 3 1 0 0 0 0
  8808. 1 4 1 0 0 0 0
  8809. 1 5 1 0 0 0 0
  8810. 5 6 1 0 0 0 0
  8811. 5 7 1 0 0 0 0
  8812. 5 11 1 0 0 0 0
  8813. 7 8 1 0 0 0 0
  8814. 7 9 1 0 0 0 0
  8815. 7 10 1 0 0 0 0
  8816. 11 12 1 0 0 0 0
  8817. 11 13 1 0 0 0 0
  8818. 11 14 1 0 0 0 0
  8819. 14 15 1 0 0 0 0
  8820. 14 16 1 0 0 0 0
  8821. 14 29 1 0 0 0 0
  8822. 16 17 1 0 0 0 0
  8823. 16 18 1 0 0 0 0
  8824. 16 19 1 0 0 0 0
  8825. 19 20 1 0 0 0 0
  8826. 19 21 1 0 0 0 0
  8827. 19 25 1 0 0 0 0
  8828. 21 22 1 0 0 0 0
  8829. 21 23 1 0 0 0 0
  8830. 21 24 1 0 0 0 0
  8831. 25 26 1 0 0 0 0
  8832. 25 27 1 0 0 0 0
  8833. 25 28 1 0 0 0 0
  8834. 29 30 1 0 0 0 0
  8835. M END
  8836. $$$$
  8837. dan256.sdf
  8838. MOE2004 3D
  8839. 30 29 0 0 0 0 0 0 0 0999 V2000
  8840. -4.0610 -0.0380 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
  8841. -4.4060 0.8850 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0
  8842. -3.6700 -0.7020 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0
  8843. -4.9290 -0.5310 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  8844. -3.0160 0.2550 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0
  8845. -3.4940 0.8160 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0
  8846. -2.6720 -0.6860 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0
  8847. -1.8270 1.0720 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0
  8848. -2.1930 2.0450 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0
  8849. -1.1620 1.2910 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0
  8850. -1.0210 0.4270 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0
  8851. -1.6540 0.3400 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0
  8852. -0.2150 1.1130 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0
  8853. -0.4280 -0.9530 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0
  8854. -1.2410 -1.6710 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0
  8855. 0.1060 -1.3080 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0
  8856. 0.5090 -1.0150 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0
  8857. -0.0650 -0.8180 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0
  8858. 0.8770 -2.0430 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0
  8859. 1.7100 -0.0630 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0
  8860. 1.3650 0.9760 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0
  8861. 2.2710 -0.1970 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0
  8862. 2.6430 -0.2990 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0
  8863. 2.9780 -1.3420 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0
  8864. 2.1060 -0.1330 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0
  8865. 3.8580 0.6240 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0
  8866. 4.4740 0.4750 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0
  8867. 3.5520 1.6740 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0
  8868. 4.6650 0.3690 0.6490 O 0 0 0 0 0 0 0 0 0 0 0 0
  8869. 4.9430 -0.5620 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0
  8870. 1 2 1 0 0 0 0
  8871. 1 3 1 0 0 0 0
  8872. 1 4 1 0 0 0 0
  8873. 1 5 1 0 0 0 0
  8874. 5 6 1 0 0 0 0
  8875. 5 7 1 0 0 0 0
  8876. 5 8 1 0 0 0 0
  8877. 8 9 1 0 0 0 0
  8878. 8 10 1 0 0 0 0
  8879. 8 11 1 0 0 0 0
  8880. 11 12 1 0 0 0 0
  8881. 11 13 1 0 0 0 0
  8882. 11 14 1 0 0 0 0
  8883. 14 15 1 0 0 0 0
  8884. 14 16 1 0 0 0 0
  8885. 14 17 1 0 0 0 0
  8886. 17 18 1 0 0 0 0
  8887. 17 19 1 0 0 0 0
  8888. 17 20 1 0 0 0 0
  8889. 20 21 1 0 0 0 0
  8890. 20 22 1 0 0 0 0
  8891. 20 23 1 0 0 0 0
  8892. 23 24 1 0 0 0 0
  8893. 23 25 1 0 0 0 0
  8894. 23 26 1 0 0 0 0
  8895. 26 27 1 0 0 0 0
  8896. 26 28 1 0 0 0 0
  8897. 26 29 1 0 0 0 0
  8898. 29 30 1 0 0 0 0
  8899. M END
  8900. $$$$
  8901. dan257.sdf
  8902. MOE2004 3D
  8903. 30 29 0 0 1 0 0 0 0 0999 V2000
  8904. 5.1930 -0.1090 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  8905. 5.2430 -0.3070 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0
  8906. 5.2800 -1.0640 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0
  8907. 6.0550 0.5070 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0
  8908. 3.9000 0.6020 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0
  8909. 3.8620 1.5660 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
  8910. 3.9000 0.8140 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
  8911. 2.6750 -0.2350 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  8912. 2.7240 -1.2020 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0
  8913. 2.6800 -0.4430 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  8914. 1.3770 0.4810 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0
  8915. 1.3270 1.4480 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0
  8916. 1.3740 0.6900 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0
  8917. 0.1500 -0.3570 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0
  8918. 0.2050 -1.3270 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0
  8919. 0.1490 -0.5590 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
  8920. -1.1470 0.3540 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0
  8921. -1.1980 1.3230 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0
  8922. -1.1430 0.5590 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0
  8923. -2.3750 -0.4890 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
  8924. -2.2970 -1.4710 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0
  8925. -2.3830 -0.6560 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
  8926. -3.6840 0.1880 -0.3290 C 0 0 3 0 0 0 0 0 0 0 0 0
  8927. -4.8930 -0.6880 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0
  8928. -4.9740 -0.8890 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0
  8929. -5.8170 -0.1790 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0
  8930. -4.8370 -1.6430 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0
  8931. -3.8370 1.4330 0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0
  8932. -3.8520 1.2520 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0
  8933. -3.6600 0.4030 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
  8934. 1 2 1 0 0 0 0
  8935. 1 3 1 0 0 0 0
  8936. 1 4 1 0 0 0 0
  8937. 1 5 1 0 0 0 0
  8938. 5 6 1 0 0 0 0
  8939. 5 7 1 0 0 0 0
  8940. 5 8 1 0 0 0 0
  8941. 8 9 1 0 0 0 0
  8942. 8 10 1 0 0 0 0
  8943. 8 11 1 0 0 0 0
  8944. 11 12 1 0 0 0 0
  8945. 11 13 1 0 0 0 0
  8946. 11 14 1 0 0 0 0
  8947. 14 15 1 0 0 0 0
  8948. 14 16 1 0 0 0 0
  8949. 14 17 1 0 0 0 0
  8950. 17 18 1 0 0 0 0
  8951. 17 19 1 0 0 0 0
  8952. 17 20 1 0 0 0 0
  8953. 20 21 1 0 0 0 0
  8954. 20 22 1 0 0 0 0
  8955. 20 23 1 0 0 0 0
  8956. 23 24 1 0 0 0 0
  8957. 23 28 1 0 0 0 0
  8958. 23 30 1 0 0 0 0
  8959. 24 25 1 0 0 0 0
  8960. 24 26 1 0 0 0 0
  8961. 24 27 1 0 0 0 0
  8962. 28 29 1 0 0 0 0
  8963. M END
  8964. $$$$
  8965. dan258.sdf
  8966. MOE2004 3D
  8967. 30 29 0 0 0 0 0 0 0 0999 V2000
  8968. -3.8910 1.0040 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0
  8969. -4.3660 1.1200 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0
  8970. -3.2410 1.8670 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
  8971. -4.6770 1.0250 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0
  8972. -3.1180 -0.3040 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0
  8973. -3.8320 -1.1320 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0
  8974. -2.6450 -0.3890 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0
  8975. -2.0790 -0.4680 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0
  8976. -2.5930 -0.4490 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0
  8977. -1.6350 -1.4660 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0
  8978. -0.9650 0.5860 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0
  8979. -1.3980 1.5670 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0
  8980. -0.3020 0.3660 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0
  8981. -0.1310 0.7030 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
  8982. -0.7690 1.0620 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0
  8983. 0.6200 1.4860 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0
  8984. 0.5620 -0.5860 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0
  8985. -0.1960 -1.3250 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  8986. 1.1140 -0.3730 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0
  8987. 1.5080 -1.2310 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0
  8988. 0.9280 -1.5870 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0
  8989. 1.9440 -2.1290 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0
  8990. 2.6430 -0.3390 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0
  8991. 2.2250 0.5220 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
  8992. 3.2080 -0.9160 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0
  8993. 3.5860 0.1300 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0
  8994. 4.0040 -0.7260 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0
  8995. 3.0640 0.7630 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  8996. 4.9590 1.0980 0.1920 S 0 0 0 0 0 0 0 0 0 0 0 0
  8997. 5.4740 0.1200 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0
  8998. 1 2 1 0 0 0 0
  8999. 1 3 1 0 0 0 0
  9000. 1 4 1 0 0 0 0
  9001. 1 5 1 0 0 0 0
  9002. 5 6 1 0 0 0 0
  9003. 5 7 1 0 0 0 0
  9004. 5 8 1 0 0 0 0
  9005. 8 9 1 0 0 0 0
  9006. 8 10 1 0 0 0 0
  9007. 8 11 1 0 0 0 0
  9008. 11 12 1 0 0 0 0
  9009. 11 13 1 0 0 0 0
  9010. 11 14 1 0 0 0 0
  9011. 14 15 1 0 0 0 0
  9012. 14 16 1 0 0 0 0
  9013. 14 17 1 0 0 0 0
  9014. 17 18 1 0 0 0 0
  9015. 17 19 1 0 0 0 0
  9016. 17 20 1 0 0 0 0
  9017. 20 21 1 0 0 0 0
  9018. 20 22 1 0 0 0 0
  9019. 20 23 1 0 0 0 0
  9020. 23 24 1 0 0 0 0
  9021. 23 25 1 0 0 0 0
  9022. 23 26 1 0 0 0 0
  9023. 26 27 1 0 0 0 0
  9024. 26 28 1 0 0 0 0
  9025. 26 29 1 0 0 0 0
  9026. 29 30 1 0 0 0 0
  9027. M END
  9028. $$$$
  9029. dan259.sdf
  9030. MOE2004 3D
  9031. 24 24 0 0 0 0 0 0 0 0999 V2000
  9032. 2.0740 -1.3800 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0
  9033. 2.0870 -2.4580 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0
  9034. 3.2820 -0.6900 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0
  9035. 4.2230 -1.2270 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0
  9036. 3.2830 0.6870 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0
  9037. 4.2250 1.2230 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0
  9038. 2.0760 1.3800 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0
  9039. 2.0910 2.4570 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0
  9040. 0.8590 0.6930 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
  9041. 0.8590 -0.6910 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0
  9042. -0.3560 -1.4940 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
  9043. -0.5470 -2.3820 0.9550 O 0 0 0 0 0 0 0 0 0 0 0 0
  9044. -1.1620 -1.1520 -0.9030 O 0 0 0 0 0 0 0 0 0 0 0 0
  9045. -2.3760 -1.9020 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0
  9046. -2.9650 -1.7660 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0
  9047. -2.9590 -1.5300 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0
  9048. -2.1620 -2.9630 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0
  9049. -0.3550 1.4970 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
  9050. -0.5420 2.3900 -0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0
  9051. -1.1640 1.1510 0.9010 O 0 0 0 0 0 0 0 0 0 0 0 0
  9052. -2.3790 1.9010 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0
  9053. -2.9670 1.7640 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
  9054. -2.9630 1.5290 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0
  9055. -2.1650 2.9620 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0
  9056. 1 2 1 0 0 0 0
  9057. 1 3 1 0 0 0 0
  9058. 1 10 2 0 0 0 0
  9059. 3 4 1 0 0 0 0
  9060. 3 5 2 0 0 0 0
  9061. 5 6 1 0 0 0 0
  9062. 5 7 1 0 0 0 0
  9063. 7 8 1 0 0 0 0
  9064. 7 9 2 0 0 0 0
  9065. 9 10 1 0 0 0 0
  9066. 9 18 1 0 0 0 0
  9067. 10 11 1 0 0 0 0
  9068. 11 12 2 0 0 0 0
  9069. 11 13 1 0 0 0 0
  9070. 13 14 1 0 0 0 0
  9071. 14 15 1 0 0 0 0
  9072. 14 16 1 0 0 0 0
  9073. 14 17 1 0 0 0 0
  9074. 18 19 2 0 0 0 0
  9075. 18 20 1 0 0 0 0
  9076. 20 21 1 0 0 0 0
  9077. 21 22 1 0 0 0 0
  9078. 21 23 1 0 0 0 0
  9079. 21 24 1 0 0 0 0
  9080. M END
  9081. $$$$
  9082. dan260.sdf
  9083. MOE2004 3D
  9084. 23 23 0 0 0 0 0 0 0 0999 V2000
  9085. 4.4380 0.1990 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0
  9086. 4.7370 -0.6850 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0
  9087. 4.8450 1.0820 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0
  9088. 4.8890 0.1300 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0
  9089. 2.9540 0.3220 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0
  9090. 2.5960 1.1770 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0
  9091. 2.0910 -0.5570 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0
  9092. 2.4610 -1.4250 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0
  9093. 0.6340 -0.4530 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0
  9094. -0.1190 -1.6290 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0
  9095. 0.3700 -2.5990 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
  9096. -1.5110 -1.5730 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0
  9097. -2.0830 -2.4910 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0
  9098. -2.1740 -0.3460 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0
  9099. -1.4310 0.8330 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
  9100. -1.9060 1.8070 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0
  9101. -0.0370 0.7750 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0
  9102. 0.5160 1.7010 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0
  9103. -3.5550 -0.4290 0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0
  9104. -4.2690 0.8090 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0
  9105. -3.9850 1.4490 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0
  9106. -4.1250 1.3220 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0
  9107. -5.3350 0.5820 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0
  9108. 1 2 1 0 0 0 0
  9109. 1 3 1 0 0 0 0
  9110. 1 4 1 0 0 0 0
  9111. 1 5 1 0 0 0 0
  9112. 5 6 1 0 0 0 0
  9113. 5 7 2 0 0 0 0
  9114. 7 8 1 0 0 0 0
  9115. 7 9 1 0 0 0 0
  9116. 9 10 2 0 0 0 0
  9117. 9 17 1 0 0 0 0
  9118. 10 11 1 0 0 0 0
  9119. 10 12 1 0 0 0 0
  9120. 12 13 1 0 0 0 0
  9121. 12 14 2 0 0 0 0
  9122. 14 15 1 0 0 0 0
  9123. 14 19 1 0 0 0 0
  9124. 15 16 1 0 0 0 0
  9125. 15 17 2 0 0 0 0
  9126. 17 18 1 0 0 0 0
  9127. 19 20 1 0 0 0 0
  9128. 20 21 1 0 0 0 0
  9129. 20 22 1 0 0 0 0
  9130. 20 23 1 0 0 0 0
  9131. M END
  9132. $$$$
  9133. dan261.sdf
  9134. MOE2004 3D
  9135. 25 25 0 0 0 0 0 0 0 0999 V2000
  9136. 3.0180 0.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9137. 2.3270 1.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9138. 2.8700 2.1540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  9139. 0.9320 1.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9140. 0.4190 2.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  9141. 0.1990 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9142. 0.9380 -1.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9143. 0.4430 -2.1670 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  9144. 2.3360 -1.1990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9145. 2.8680 -2.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  9146. -1.3450 0.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9147. -1.8500 0.7670 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0
  9148. -1.4860 0.2850 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0
  9149. -2.9450 0.7760 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0
  9150. -1.5230 1.8120 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
  9151. -1.8500 0.7700 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0
  9152. -1.4840 0.2910 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  9153. -1.5240 1.8150 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
  9154. -2.9440 0.7780 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0
  9155. -1.9970 -1.3720 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
  9156. -1.7150 -1.9500 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
  9157. -3.0910 -1.3020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  9158. -1.7150 -1.9520 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0
  9159. 4.3900 0.0620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
  9160. 4.7300 -0.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  9161. 1 2 2 0 0 0 0
  9162. 1 9 1 0 0 0 0
  9163. 1 24 1 0 0 0 0
  9164. 2 3 1 0 0 0 0
  9165. 2 4 1 0 0 0 0
  9166. 4 5 1 0 0 0 0
  9167. 4 6 2 0 0 0 0
  9168. 6 7 1 0 0 0 0
  9169. 6 11 1 0 0 0 0
  9170. 7 8 1 0 0 0 0
  9171. 7 9 2 0 0 0 0
  9172. 9 10 1 0 0 0 0
  9173. 11 12 1 0 0 0 0
  9174. 11 16 1 0 0 0 0
  9175. 11 20 1 0 0 0 0
  9176. 12 13 1 0 0 0 0
  9177. 12 14 1 0 0 0 0
  9178. 12 15 1 0 0 0 0
  9179. 16 17 1 0 0 0 0
  9180. 16 18 1 0 0 0 0
  9181. 16 19 1 0 0 0 0
  9182. 20 21 1 0 0 0 0
  9183. 20 22 1 0 0 0 0
  9184. 20 23 1 0 0 0 0
  9185. 24 25 1 0 0 0 0
  9186. M END
  9187. $$$$
  9188. dan262.sdf
  9189. MOE2004 3D
  9190. 32 31 0 0 0 0 0 0 0 0999 V2000
  9191. 5.3550 0.1600 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0
  9192. 5.6410 1.2150 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9193. 6.0640 -0.4040 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0
  9194. 5.4520 -0.1860 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0
  9195. 3.9370 -0.0410 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0
  9196. 3.7090 -1.1110 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9197. 3.8820 0.2870 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0
  9198. 2.9230 0.7350 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0
  9199. 3.2190 1.7890 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0
  9200. 2.9470 0.3730 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0
  9201. 1.4900 0.6590 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0
  9202. 1.4700 1.0030 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0
  9203. 0.8820 1.3650 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  9204. 0.8760 -0.7420 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0
  9205. 0.8860 -1.0790 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  9206. 1.4910 -1.4510 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0
  9207. -0.5490 -0.8230 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0
  9208. -0.8460 -1.8780 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0
  9209. -0.5600 -0.4780 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0
  9210. -1.5730 -0.0330 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0
  9211. -1.3430 1.0370 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0
  9212. -1.5170 -0.3370 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0
  9213. -2.9930 -0.2570 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0
  9214. -3.2340 -1.3260 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0
  9215. -3.0550 0.0430 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0
  9216. -4.0190 0.5260 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0
  9217. -3.8070 1.6010 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0
  9218. -3.9940 0.2470 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0
  9219. -5.4140 0.3070 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0
  9220. -6.0050 1.1000 0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0
  9221. -5.9500 -0.8790 -0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0
  9222. -5.3670 -1.4200 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0
  9223. 1 2 1 0 0 0 0
  9224. 1 3 1 0 0 0 0
  9225. 1 4 1 0 0 0 0
  9226. 1 5 1 0 0 0 0
  9227. 5 6 1 0 0 0 0
  9228. 5 7 1 0 0 0 0
  9229. 5 8 1 0 0 0 0
  9230. 8 9 1 0 0 0 0
  9231. 8 10 1 0 0 0 0
  9232. 8 11 1 0 0 0 0
  9233. 11 12 1 0 0 0 0
  9234. 11 13 1 0 0 0 0
  9235. 11 14 1 0 0 0 0
  9236. 14 15 1 0 0 0 0
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  9239. 17 18 1 0 0 0 0
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  9250. 26 29 1 0 0 0 0
  9251. 29 30 2 0 0 0 0
  9252. 29 31 1 0 0 0 0
  9253. 31 32 1 0 0 0 0
  9254. M END
  9255. $$$$
  9256. dan263.sdf
  9257. MOE2004 3D
  9258. 32 31 0 0 0 0 0 0 0 0999 V2000
  9259. 4.3100 -0.2300 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0
  9260. 4.1230 -0.2300 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0
  9261. 5.1220 0.4790 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0
  9262. 4.6610 -1.2280 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0
  9263. 3.0480 0.1570 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0
  9264. 2.7510 1.1610 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0
  9265. 3.3560 0.2110 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0
  9266. 2.5090 0.6060 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0
  9267. 3.5960 -0.7820 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0
  9268. 4.2100 0.8670 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0
  9269. 1.9090 -0.8230 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0
  9270. 1.7700 -0.8670 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0
  9271. 2.1830 -1.8430 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0
  9272. 0.5720 -0.4620 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0
  9273. 0.6360 -0.5630 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0
  9274. 0.2960 0.5610 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0
  9275. -0.4190 -1.3760 -0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0
  9276. -1.7090 -1.4000 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0
  9277. -2.4530 -2.3230 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0
  9278. -2.1980 -0.2430 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0
  9279. -1.3730 0.2920 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0
  9280. -2.7420 -0.6930 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0
  9281. -3.1140 0.7530 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0
  9282. -3.4120 1.5090 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0
  9283. -4.4000 0.1040 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0
  9284. -5.0930 0.8670 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0
  9285. -4.2070 -0.5880 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0
  9286. -4.9090 -0.4460 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9287. -2.3930 1.4860 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0
  9288. -1.5190 2.0230 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0
  9289. -2.0600 0.7980 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0
  9290. -3.0540 2.2240 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0
  9291. 1 2 1 0 0 0 0
  9292. 1 3 1 0 0 0 0
  9293. 1 4 1 0 0 0 0
  9294. 1 5 1 0 0 0 0
  9295. 5 6 1 0 0 0 0
  9296. 5 7 1 0 0 0 0
  9297. 5 11 1 0 0 0 0
  9298. 7 8 1 0 0 0 0
  9299. 7 9 1 0 0 0 0
  9300. 7 10 1 0 0 0 0
  9301. 11 12 1 0 0 0 0
  9302. 11 13 1 0 0 0 0
  9303. 11 14 1 0 0 0 0
  9304. 14 15 1 0 0 0 0
  9305. 14 16 1 0 0 0 0
  9306. 14 17 1 0 0 0 0
  9307. 17 18 1 0 0 0 0
  9308. 18 19 2 0 0 0 0
  9309. 18 20 1 0 0 0 0
  9310. 20 21 1 0 0 0 0
  9311. 20 22 1 0 0 0 0
  9312. 20 23 1 0 0 0 0
  9313. 23 24 1 0 0 0 0
  9314. 23 25 1 0 0 0 0
  9315. 23 29 1 0 0 0 0
  9316. 25 26 1 0 0 0 0
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  9318. 25 28 1 0 0 0 0
  9319. 29 30 1 0 0 0 0
  9320. 29 31 1 0 0 0 0
  9321. 29 32 1 0 0 0 0
  9322. M END
  9323. $$$$
  9324. dan264.sdf
  9325. MOE2004 3D
  9326. 32 31 0 0 0 0 0 0 0 0999 V2000
  9327. 5.5050 -0.2330 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0
  9328. 5.7590 -1.0450 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0
  9329. 6.2480 0.5610 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0
  9330. 5.5850 -0.6120 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0
  9331. 4.1090 0.3020 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0
  9332. 3.9150 1.1370 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  9333. 4.0730 0.7000 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0
  9334. 3.0480 -0.7870 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0
  9335. 3.3120 -1.6440 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0
  9336. 3.0530 -1.1500 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0
  9337. 1.6360 -0.3330 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0
  9338. 1.6350 0.0460 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0
  9339. 0.9900 -1.2170 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
  9340. 1.0620 0.7290 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0
  9341. 1.0540 0.3460 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0
  9342. 1.7110 1.6100 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0
  9343. -0.3460 1.1920 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
  9344. -0.6110 2.0460 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9345. -0.3410 1.5600 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0
  9346. -1.4130 0.1080 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0
  9347. -1.2130 -0.7370 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0
  9348. -1.3900 -0.3020 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
  9349. -2.8080 0.6460 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
  9350. -3.0530 1.4620 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0
  9351. -2.8580 1.0160 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0
  9352. -3.7480 -0.4230 0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0
  9353. -5.0470 -0.0780 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0
  9354. -5.4420 1.0300 -0.4480 O 0 0 0 0 0 0 0 0 0 0 0 0
  9355. -5.9360 -1.2670 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
  9356. -5.6610 -2.0620 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0
  9357. -5.8540 -1.6180 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0
  9358. -6.9750 -0.9810 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0
  9359. 1 2 1 0 0 0 0
  9360. 1 3 1 0 0 0 0
  9361. 1 4 1 0 0 0 0
  9362. 1 5 1 0 0 0 0
  9363. 5 6 1 0 0 0 0
  9364. 5 7 1 0 0 0 0
  9365. 5 8 1 0 0 0 0
  9366. 8 9 1 0 0 0 0
  9367. 8 10 1 0 0 0 0
  9368. 8 11 1 0 0 0 0
  9369. 11 12 1 0 0 0 0
  9370. 11 13 1 0 0 0 0
  9371. 11 14 1 0 0 0 0
  9372. 14 15 1 0 0 0 0
  9373. 14 16 1 0 0 0 0
  9374. 14 17 1 0 0 0 0
  9375. 17 18 1 0 0 0 0
  9376. 17 19 1 0 0 0 0
  9377. 17 20 1 0 0 0 0
  9378. 20 21 1 0 0 0 0
  9379. 20 22 1 0 0 0 0
  9380. 20 23 1 0 0 0 0
  9381. 23 24 1 0 0 0 0
  9382. 23 25 1 0 0 0 0
  9383. 23 26 1 0 0 0 0
  9384. 26 27 1 0 0 0 0
  9385. 27 28 2 0 0 0 0
  9386. 27 29 1 0 0 0 0
  9387. 29 30 1 0 0 0 0
  9388. 29 31 1 0 0 0 0
  9389. 29 32 1 0 0 0 0
  9390. M END
  9391. $$$$
  9392. dan265.sdf
  9393. MOE2004 3D
  9394. 33 32 0 0 0 0 0 0 0 0999 V2000
  9395. -4.5140 0.5650 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0
  9396. -5.1720 0.2650 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
  9397. -4.3270 -0.3110 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0
  9398. -5.0470 1.3000 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0
  9399. -3.2170 1.1620 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  9400. -3.4530 2.0950 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0
  9401. -2.5740 1.4380 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0
  9402. -2.4680 0.2420 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0
  9403. -3.1060 0.0520 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0
  9404. -1.5930 0.7760 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
  9405. -2.0300 -1.1100 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0
  9406. -2.9170 -1.7040 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0
  9407. -1.5160 -1.6730 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0
  9408. -1.1340 -1.0430 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0
  9409. -1.7090 -0.6300 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0
  9410. -0.8770 -2.0670 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0
  9411. 0.1590 -0.2330 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0
  9412. -0.0740 0.8130 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0
  9413. 0.6570 -0.2290 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0
  9414. 1.1120 -0.7960 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0
  9415. 1.3630 -1.8350 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0
  9416. 0.6060 -0.8130 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  9417. 2.3980 0.0210 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0
  9418. 2.9260 -0.3630 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0
  9419. 2.1440 1.0650 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0
  9420. 3.3250 -0.0410 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0
  9421. 2.8130 0.3570 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0
  9422. 3.5730 -1.0890 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0
  9423. 4.6140 0.7530 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0
  9424. 4.4100 1.7930 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0
  9425. 5.1900 0.7600 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0
  9426. 5.4320 0.1610 -0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0
  9427. 5.0070 0.3180 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
  9428. 1 2 1 0 0 0 0
  9429. 1 3 1 0 0 0 0
  9430. 1 4 1 0 0 0 0
  9431. 1 5 1 0 0 0 0
  9432. 5 6 1 0 0 0 0
  9433. 5 7 1 0 0 0 0
  9434. 5 8 1 0 0 0 0
  9435. 8 9 1 0 0 0 0
  9436. 8 10 1 0 0 0 0
  9437. 8 11 1 0 0 0 0
  9438. 11 12 1 0 0 0 0
  9439. 11 13 1 0 0 0 0
  9440. 11 14 1 0 0 0 0
  9441. 14 15 1 0 0 0 0
  9442. 14 16 1 0 0 0 0
  9443. 14 17 1 0 0 0 0
  9444. 17 18 1 0 0 0 0
  9445. 17 19 1 0 0 0 0
  9446. 17 20 1 0 0 0 0
  9447. 20 21 1 0 0 0 0
  9448. 20 22 1 0 0 0 0
  9449. 20 23 1 0 0 0 0
  9450. 23 24 1 0 0 0 0
  9451. 23 25 1 0 0 0 0
  9452. 23 26 1 0 0 0 0
  9453. 26 27 1 0 0 0 0
  9454. 26 28 1 0 0 0 0
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  9456. 29 30 1 0 0 0 0
  9457. 29 31 1 0 0 0 0
  9458. 29 32 1 0 0 0 0
  9459. 32 33 1 0 0 0 0
  9460. M END
  9461. $$$$
  9462. dan266.sdf
  9463. MOE2004 3D
  9464. 33 32 0 0 0 0 0 0 0 0999 V2000
  9465. -4.4120 -0.5520 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0
  9466. -4.9970 -0.1540 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0
  9467. -3.9000 -1.4580 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0
  9468. -5.1100 -0.8420 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0
  9469. -3.4290 0.4840 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0
  9470. -3.9980 1.3170 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0
  9471. -2.8500 0.0550 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0
  9472. -2.4950 1.0430 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0
  9473. -3.1000 1.5410 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  9474. -1.8760 1.8290 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0
  9475. -1.5930 0.0150 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0
  9476. -2.2140 -0.6830 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0
  9477. -0.9840 0.5380 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0
  9478. -0.6780 -0.7980 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0
  9479. -1.2920 -1.4290 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0
  9480. -0.0980 -1.4950 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0
  9481. 0.2750 0.0230 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0
  9482. -0.3090 0.6240 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0
  9483. 0.8540 -0.6690 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
  9484. 1.2330 0.9540 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0
  9485. 0.6550 1.7280 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0
  9486. 1.8410 1.4920 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0
  9487. 2.1530 0.2740 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0
  9488. 1.5470 -0.1430 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0
  9489. 2.7740 1.0430 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
  9490. 3.0510 -0.8430 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0
  9491. 2.4200 -1.6770 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0
  9492. 3.6550 -1.2440 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9493. 3.9710 -0.4560 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0
  9494. 3.3950 -0.0960 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0
  9495. 4.5210 -1.3420 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0
  9496. 5.1950 0.8100 0.3040 S 0 0 0 0 0 0 0 0 0 0 0 0
  9497. 5.7890 0.1110 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0
  9498. 1 2 1 0 0 0 0
  9499. 1 3 1 0 0 0 0
  9500. 1 4 1 0 0 0 0
  9501. 1 5 1 0 0 0 0
  9502. 5 6 1 0 0 0 0
  9503. 5 7 1 0 0 0 0
  9504. 5 8 1 0 0 0 0
  9505. 8 9 1 0 0 0 0
  9506. 8 10 1 0 0 0 0
  9507. 8 11 1 0 0 0 0
  9508. 11 12 1 0 0 0 0
  9509. 11 13 1 0 0 0 0
  9510. 11 14 1 0 0 0 0
  9511. 14 15 1 0 0 0 0
  9512. 14 16 1 0 0 0 0
  9513. 14 17 1 0 0 0 0
  9514. 17 18 1 0 0 0 0
  9515. 17 19 1 0 0 0 0
  9516. 17 20 1 0 0 0 0
  9517. 20 21 1 0 0 0 0
  9518. 20 22 1 0 0 0 0
  9519. 20 23 1 0 0 0 0
  9520. 23 24 1 0 0 0 0
  9521. 23 25 1 0 0 0 0
  9522. 23 26 1 0 0 0 0
  9523. 26 27 1 0 0 0 0
  9524. 26 28 1 0 0 0 0
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  9526. 29 30 1 0 0 0 0
  9527. 29 31 1 0 0 0 0
  9528. 29 32 1 0 0 0 0
  9529. 32 33 1 0 0 0 0
  9530. M END
  9531. $$$$
  9532. dan267.sdf
  9533. MOE2004 3D
  9534. 33 32 0 0 1 0 0 0 0 0999 V2000
  9535. 5.1670 0.2890 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0
  9536. 5.8160 0.6480 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0
  9537. 5.6300 0.0590 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0
  9538. 3.8520 0.1330 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0
  9539. 3.2450 -0.2170 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0
  9540. 3.2380 0.4630 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0
  9541. 3.8390 1.0920 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0
  9542. 1.9560 0.0430 -0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0
  9543. 1.2340 -0.8180 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0
  9544. 1.0500 -0.2880 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
  9545. 1.8380 -1.7110 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0
  9546. -0.0970 -1.2390 -0.5750 C 0 0 3 0 0 0 0 0 0 0 0 0
  9547. -0.9410 -0.0270 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0
  9548. -1.8090 -0.3860 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0
  9549. -0.3580 0.5590 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0
  9550. -1.4180 0.9040 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
  9551. -0.5600 1.3020 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0
  9552. -2.0320 0.3480 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0
  9553. -2.2350 2.0700 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0
  9554. -3.1050 1.6880 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0
  9555. -1.6310 2.6390 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0
  9556. -2.7080 3.0010 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0
  9557. -3.2890 3.8270 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0
  9558. -3.3450 2.4710 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0
  9559. -1.8610 3.4270 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
  9560. -0.8460 -2.2040 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0
  9561. -1.0680 -1.7160 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0
  9562. -0.1870 -3.0480 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0
  9563. -2.1340 -2.7660 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0
  9564. -2.8950 -1.9900 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0
  9565. -1.9550 -3.2300 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0
  9566. -2.5470 -3.5300 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0
  9567. 0.1560 -1.7930 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0
  9568. 1 2 1 0 0 0 0
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  9598. 29 31 1 0 0 0 0
  9599. 29 32 1 0 0 0 0
  9600. M END
  9601. $$$$
  9602. dan268.sdf
  9603. MOE2004 3D
  9604. 35 34 0 0 0 0 0 0 0 0999 V2000
  9605. 5.2090 1.7100 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0
  9606. 6.0970 1.0860 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0
  9607. 5.0310 2.2610 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0
  9608. 5.4260 2.4370 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0
  9609. 4.0000 0.8680 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0
  9610. 4.2020 0.3550 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9611. 3.1480 1.5350 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0
  9612. 3.6690 -0.1560 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0
  9613. 3.4140 0.3630 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
  9614. 4.5620 -0.7550 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0
  9615. 2.5350 -1.1110 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0
  9616. 2.4460 -1.8680 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0
  9617. 2.8000 -1.6460 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0
  9618. 1.1820 -0.4150 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
  9619. 1.2270 0.2770 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0
  9620. 0.9640 0.1790 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0
  9621. 0.0620 -1.4320 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0
  9622. -0.0420 -2.0820 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0
  9623. 0.3440 -2.0820 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0
  9624. -1.2900 -0.7930 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0
  9625. -1.9780 -1.5970 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0
  9626. -1.1870 -0.1470 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0
  9627. -1.8870 0.0080 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0
  9628. -1.2020 0.8170 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0
  9629. -1.9870 -0.6350 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0
  9630. -3.2410 0.6430 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0
  9631. -3.1470 1.2780 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0
  9632. -3.5160 1.3130 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9633. -4.3570 -0.3780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
  9634. -4.4360 -1.0750 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0
  9635. -4.1740 -0.9880 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0
  9636. -5.6860 0.3150 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
  9637. -6.2000 0.5210 1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0
  9638. -6.2540 0.7070 -0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0
  9639. -5.7320 0.4860 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0
  9640. 1 2 1 0 0 0 0
  9641. 1 3 1 0 0 0 0
  9642. 1 4 1 0 0 0 0
  9643. 1 5 1 0 0 0 0
  9644. 5 6 1 0 0 0 0
  9645. 5 7 1 0 0 0 0
  9646. 5 8 1 0 0 0 0
  9647. 8 9 1 0 0 0 0
  9648. 8 10 1 0 0 0 0
  9649. 8 11 1 0 0 0 0
  9650. 11 12 1 0 0 0 0
  9651. 11 13 1 0 0 0 0
  9652. 11 14 1 0 0 0 0
  9653. 14 15 1 0 0 0 0
  9654. 14 16 1 0 0 0 0
  9655. 14 17 1 0 0 0 0
  9656. 17 18 1 0 0 0 0
  9657. 17 19 1 0 0 0 0
  9658. 17 20 1 0 0 0 0
  9659. 20 21 1 0 0 0 0
  9660. 20 22 1 0 0 0 0
  9661. 20 23 1 0 0 0 0
  9662. 23 24 1 0 0 0 0
  9663. 23 25 1 0 0 0 0
  9664. 23 26 1 0 0 0 0
  9665. 26 27 1 0 0 0 0
  9666. 26 28 1 0 0 0 0
  9667. 26 29 1 0 0 0 0
  9668. 29 30 1 0 0 0 0
  9669. 29 31 1 0 0 0 0
  9670. 29 32 1 0 0 0 0
  9671. 32 33 2 0 0 0 0
  9672. 32 34 1 0 0 0 0
  9673. 34 35 1 0 0 0 0
  9674. M END
  9675. $$$$
  9676. dan269.sdf
  9677. MOE2004 3D
  9678. 35 34 0 0 0 0 0 0 0 0999 V2000
  9679. 6.0250 0.0990 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0
  9680. 6.2800 0.7590 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0
  9681. 6.7110 0.3170 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0
  9682. 6.1920 -0.9350 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0
  9683. 4.5850 0.3100 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0
  9684. 4.3880 -0.3360 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0
  9685. 4.4610 1.3450 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0
  9686. 3.6010 0.0070 -0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0
  9687. 3.8720 0.6060 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0
  9688. 3.6910 -1.0430 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0
  9689. 2.1430 0.3170 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0
  9690. 2.0570 1.3640 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0
  9691. 1.5510 0.2140 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0
  9692. 1.5700 -0.6000 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0
  9693. 1.6380 -1.6450 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
  9694. 2.1740 -0.5160 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0
  9695. 0.1220 -0.2720 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0
  9696. -0.1550 -0.8920 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0
  9697. 0.0560 0.7700 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0
  9698. -0.8790 -0.5160 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  9699. -0.6720 0.1590 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0
  9700. -0.7670 -1.5400 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0
  9701. -2.3160 -0.2980 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0
  9702. -2.5410 -0.9750 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0
  9703. -2.4260 0.7200 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0
  9704. -3.3180 -0.5280 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0
  9705. -3.1500 0.1610 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0
  9706. -3.2210 -1.5410 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0
  9707. -4.7310 -0.3580 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0
  9708. -5.4790 -1.2880 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0
  9709. -5.0360 0.9680 -0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0
  9710. -6.3540 1.2270 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0
  9711. -6.4860 0.7960 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
  9712. -6.4830 2.3100 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0
  9713. -7.1040 0.8340 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0
  9714. 1 2 1 0 0 0 0
  9715. 1 3 1 0 0 0 0
  9716. 1 4 1 0 0 0 0
  9717. 1 5 1 0 0 0 0
  9718. 5 6 1 0 0 0 0
  9719. 5 7 1 0 0 0 0
  9720. 5 8 1 0 0 0 0
  9721. 8 9 1 0 0 0 0
  9722. 8 10 1 0 0 0 0
  9723. 8 11 1 0 0 0 0
  9724. 11 12 1 0 0 0 0
  9725. 11 13 1 0 0 0 0
  9726. 11 14 1 0 0 0 0
  9727. 14 15 1 0 0 0 0
  9728. 14 16 1 0 0 0 0
  9729. 14 17 1 0 0 0 0
  9730. 17 18 1 0 0 0 0
  9731. 17 19 1 0 0 0 0
  9732. 17 20 1 0 0 0 0
  9733. 20 21 1 0 0 0 0
  9734. 20 22 1 0 0 0 0
  9735. 20 23 1 0 0 0 0
  9736. 23 24 1 0 0 0 0
  9737. 23 25 1 0 0 0 0
  9738. 23 26 1 0 0 0 0
  9739. 26 27 1 0 0 0 0
  9740. 26 28 1 0 0 0 0
  9741. 26 29 1 0 0 0 0
  9742. 29 30 2 0 0 0 0
  9743. 29 31 1 0 0 0 0
  9744. 31 32 1 0 0 0 0
  9745. 32 33 1 0 0 0 0
  9746. 32 34 1 0 0 0 0
  9747. 32 35 1 0 0 0 0
  9748. M END
  9749. $$$$
  9750. dan270.sdf
  9751. MOE2004 3D
  9752. 36 35 0 0 0 0 0 0 0 0999 V2000
  9753. -5.0260 0.4290 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0
  9754. -5.2500 1.3000 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0
  9755. -4.7770 -0.4100 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0
  9756. -5.9370 0.1620 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0
  9757. -3.8990 0.7300 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0
  9758. -4.2460 1.4940 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
  9759. -3.6860 -0.1630 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0
  9760. -2.6230 1.2410 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0
  9761. -2.8500 2.1820 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
  9762. -1.8950 1.4980 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0
  9763. -1.9770 0.2840 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0
  9764. -2.6540 0.1430 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0
  9765. -1.0870 0.7680 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0
  9766. -1.5930 -1.0960 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0
  9767. -2.5020 -1.6400 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0
  9768. -1.1500 -1.6810 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9769. -0.6400 -1.0910 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0
  9770. -1.1510 -0.6540 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0
  9771. -0.4290 -2.1310 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  9772. 0.6890 -0.3550 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0
  9773. 0.5070 0.7060 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0
  9774. 1.2340 -0.3960 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0
  9775. 1.5560 -0.9530 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0
  9776. 1.7560 -2.0090 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
  9777. 1.0070 -0.9230 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0
  9778. 2.8780 -0.2090 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0
  9779. 3.3620 -0.6170 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0
  9780. 2.6730 0.8470 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0
  9781. 3.8420 -0.3300 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0
  9782. 3.4090 0.1650 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0
  9783. 3.9860 -1.3860 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0
  9784. 5.2000 0.3000 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0
  9785. 5.8800 0.1630 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0
  9786. 5.6610 -0.1580 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0
  9787. 5.0690 1.6960 -0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0
  9788. 4.6630 2.0950 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0
  9789. 1 2 1 0 0 0 0
  9790. 1 3 1 0 0 0 0
  9791. 1 4 1 0 0 0 0
  9792. 1 5 1 0 0 0 0
  9793. 5 6 1 0 0 0 0
  9794. 5 7 1 0 0 0 0
  9795. 5 8 1 0 0 0 0
  9796. 8 9 1 0 0 0 0
  9797. 8 10 1 0 0 0 0
  9798. 8 11 1 0 0 0 0
  9799. 11 12 1 0 0 0 0
  9800. 11 13 1 0 0 0 0
  9801. 11 14 1 0 0 0 0
  9802. 14 15 1 0 0 0 0
  9803. 14 16 1 0 0 0 0
  9804. 14 17 1 0 0 0 0
  9805. 17 18 1 0 0 0 0
  9806. 17 19 1 0 0 0 0
  9807. 17 20 1 0 0 0 0
  9808. 20 21 1 0 0 0 0
  9809. 20 22 1 0 0 0 0
  9810. 20 23 1 0 0 0 0
  9811. 23 24 1 0 0 0 0
  9812. 23 25 1 0 0 0 0
  9813. 23 26 1 0 0 0 0
  9814. 26 27 1 0 0 0 0
  9815. 26 28 1 0 0 0 0
  9816. 26 29 1 0 0 0 0
  9817. 29 30 1 0 0 0 0
  9818. 29 31 1 0 0 0 0
  9819. 29 32 1 0 0 0 0
  9820. 32 33 1 0 0 0 0
  9821. 32 34 1 0 0 0 0
  9822. 32 35 1 0 0 0 0
  9823. 35 36 1 0 0 0 0
  9824. M END
  9825. $$$$
  9826. dan271.sdf
  9827. MOE2004 3D
  9828. 30 30 0 0 0 0 0 0 0 0999 V2000
  9829. -1.3230 -2.4600 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0
  9830. -2.3500 -2.4760 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0
  9831. -0.6590 -3.6660 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0
  9832. -1.1720 -4.6090 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0
  9833. 0.6650 -3.6650 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0
  9834. 1.1790 -4.6070 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0
  9835. 1.3270 -2.4570 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0
  9836. 2.3530 -2.4710 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0
  9837. 0.6620 -1.2450 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0
  9838. -0.6610 -1.2470 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0
  9839. -1.3450 -0.0020 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0
  9840. -0.8720 0.8610 1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0
  9841. -2.5460 0.0160 -0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0
  9842. -3.3260 1.2070 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0
  9843. -3.2440 1.5860 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0
  9844. -4.3740 0.9330 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0
  9845. -2.9180 2.2600 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0
  9846. -1.8740 2.5580 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0
  9847. -3.0020 1.8680 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0
  9848. -3.5480 3.1500 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0
  9849. 1.3420 0.0020 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0
  9850. 0.8630 0.8690 -1.2540 O 0 0 0 0 0 0 0 0 0 0 0 0
  9851. 2.5480 0.0190 0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0
  9852. 3.3230 1.2130 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0
  9853. 3.2330 1.5990 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0
  9854. 4.3730 0.9410 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0
  9855. 2.9180 2.2590 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0
  9856. 1.8730 2.5550 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0
  9857. 3.0080 1.8590 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
  9858. 3.5460 3.1500 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0
  9859. 1 2 1 0 0 0 0
  9860. 1 3 1 0 0 0 0
  9861. 1 10 2 0 0 0 0
  9862. 3 4 1 0 0 0 0
  9863. 3 5 2 0 0 0 0
  9864. 5 6 1 0 0 0 0
  9865. 5 7 1 0 0 0 0
  9866. 7 8 1 0 0 0 0
  9867. 7 9 2 0 0 0 0
  9868. 9 10 1 0 0 0 0
  9869. 9 21 1 0 0 0 0
  9870. 10 11 1 0 0 0 0
  9871. 11 12 2 0 0 0 0
  9872. 11 13 1 0 0 0 0
  9873. 13 14 1 0 0 0 0
  9874. 14 15 1 0 0 0 0
  9875. 14 16 1 0 0 0 0
  9876. 14 17 1 0 0 0 0
  9877. 17 18 1 0 0 0 0
  9878. 17 19 1 0 0 0 0
  9879. 17 20 1 0 0 0 0
  9880. 21 22 2 0 0 0 0
  9881. 21 23 1 0 0 0 0
  9882. 23 24 1 0 0 0 0
  9883. 24 25 1 0 0 0 0
  9884. 24 26 1 0 0 0 0
  9885. 24 27 1 0 0 0 0
  9886. 27 28 1 0 0 0 0
  9887. 27 29 1 0 0 0 0
  9888. 27 30 1 0 0 0 0
  9889. M END
  9890. $$$$
  9891. dan272.sdf
  9892. MOE2004 3D
  9893. 38 37 0 0 0 0 0 0 0 0999 V2000
  9894. 6.0330 1.7740 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0
  9895. 6.8800 1.1760 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
  9896. 6.1080 2.7660 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0
  9897. 6.1210 1.8930 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0
  9898. 4.7110 1.1200 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0
  9899. 3.8950 1.7710 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0
  9900. 4.6440 1.0430 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0
  9901. 4.5770 -0.2670 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0
  9902. 5.4480 -0.8720 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0
  9903. 4.5920 -0.1810 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0
  9904. 3.3160 -1.0180 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0
  9905. 3.3030 -1.1070 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
  9906. 3.3730 -2.0390 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0
  9907. 2.0170 -0.3680 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
  9908. 2.0520 -0.2400 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0
  9909. 1.9100 0.6300 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0
  9910. 0.7990 -1.2130 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0
  9911. 0.7630 -1.3390 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
  9912. 0.8970 -2.2150 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
  9913. -0.5020 -0.5700 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0
  9914. -0.4710 -0.4550 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0
  9915. -0.5850 0.4350 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0
  9916. -1.7190 -1.4100 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0
  9917. -1.7830 -1.4800 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
  9918. -1.5850 -2.4330 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
  9919. -3.0390 -0.8710 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0
  9920. -3.8360 -1.5860 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0
  9921. -3.0000 -0.8270 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0
  9922. -3.4210 0.5040 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
  9923. -2.7050 1.2620 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0
  9924. -3.4150 0.5190 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0
  9925. -4.7020 0.9000 0.4330 O 0 0 0 0 0 0 0 0 0 0 0 0
  9926. -5.7910 0.5030 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0
  9927. -5.7680 -0.1640 -1.3170 O 0 0 0 0 0 0 0 0 0 0 0 0
  9928. -7.0440 1.0000 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
  9929. -7.0170 2.0910 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
  9930. -7.9090 0.7150 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0
  9931. -7.1470 0.5510 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0
  9932. 1 2 1 0 0 0 0
  9933. 1 3 1 0 0 0 0
  9934. 1 4 1 0 0 0 0
  9935. 1 5 1 0 0 0 0
  9936. 5 6 1 0 0 0 0
  9937. 5 7 1 0 0 0 0
  9938. 5 8 1 0 0 0 0
  9939. 8 9 1 0 0 0 0
  9940. 8 10 1 0 0 0 0
  9941. 8 11 1 0 0 0 0
  9942. 11 12 1 0 0 0 0
  9943. 11 13 1 0 0 0 0
  9944. 11 14 1 0 0 0 0
  9945. 14 15 1 0 0 0 0
  9946. 14 16 1 0 0 0 0
  9947. 14 17 1 0 0 0 0
  9948. 17 18 1 0 0 0 0
  9949. 17 19 1 0 0 0 0
  9950. 17 20 1 0 0 0 0
  9951. 20 21 1 0 0 0 0
  9952. 20 22 1 0 0 0 0
  9953. 20 23 1 0 0 0 0
  9954. 23 24 1 0 0 0 0
  9955. 23 25 1 0 0 0 0
  9956. 23 26 1 0 0 0 0
  9957. 26 27 1 0 0 0 0
  9958. 26 28 1 0 0 0 0
  9959. 26 29 1 0 0 0 0
  9960. 29 30 1 0 0 0 0
  9961. 29 31 1 0 0 0 0
  9962. 29 32 1 0 0 0 0
  9963. 32 33 1 0 0 0 0
  9964. 33 34 2 0 0 0 0
  9965. 33 35 1 0 0 0 0
  9966. 35 36 1 0 0 0 0
  9967. 35 37 1 0 0 0 0
  9968. 35 38 1 0 0 0 0
  9969. M END
  9970. $$$$
  9971. dan273.sdf
  9972. MOE2004 3D
  9973. 38 37 0 0 0 0 0 0 0 0999 V2000
  9974. 6.1490 0.9440 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
  9975. 6.2060 2.0050 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
  9976. 6.2420 0.8540 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0
  9977. 7.0050 0.4380 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0
  9978. 4.8480 0.3280 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0
  9979. 4.8010 0.4110 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0
  9980. 4.8540 -0.7380 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0
  9981. 3.6330 1.0140 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0
  9982. 3.6570 0.8900 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0
  9983. 3.6940 2.0920 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0
  9984. 2.2930 0.5100 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0
  9985. 1.5090 1.1650 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0
  9986. 2.2760 0.6180 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0
  9987. 1.9860 -0.9420 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0
  9988. 2.7740 -1.5970 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0
  9989. 1.9960 -1.0470 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
  9990. 0.6510 -1.4510 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0
  9991. 0.6380 -1.3390 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0
  9992. 0.5880 -2.5270 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0
  9993. -0.5720 -0.7570 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0
  9994. -0.5280 -0.8260 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0
  9995. -0.5560 0.3050 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0
  9996. -1.8730 -1.3880 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0
  9997. -1.9420 -1.2780 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0
  9998. -1.8500 -2.4650 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
  9999. -3.1300 -0.8080 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0
  10000. -3.9840 -1.4180 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0
  10001. -3.0580 -0.9130 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0
  10002. -3.3890 0.6580 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
  10003. -2.5600 1.2770 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0
  10004. -3.4240 0.7660 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0
  10005. -4.6770 1.1970 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0
  10006. -4.7080 1.0150 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0
  10007. -4.7240 2.2850 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0
  10008. -5.9070 0.6290 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0
  10009. -6.3080 0.9850 -1.2440 O 0 0 0 0 0 0 0 0 0 0 0 0
  10010. -6.5190 -0.3420 0.5770 O 0 0 0 0 0 0 0 0 0 0 0 0
  10011. -6.0890 -0.5500 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0
  10012. 1 2 1 0 0 0 0
  10013. 1 3 1 0 0 0 0
  10014. 1 4 1 0 0 0 0
  10015. 1 5 1 0 0 0 0
  10016. 5 6 1 0 0 0 0
  10017. 5 7 1 0 0 0 0
  10018. 5 8 1 0 0 0 0
  10019. 8 9 1 0 0 0 0
  10020. 8 10 1 0 0 0 0
  10021. 8 11 1 0 0 0 0
  10022. 11 12 1 0 0 0 0
  10023. 11 13 1 0 0 0 0
  10024. 11 14 1 0 0 0 0
  10025. 14 15 1 0 0 0 0
  10026. 14 16 1 0 0 0 0
  10027. 14 17 1 0 0 0 0
  10028. 17 18 1 0 0 0 0
  10029. 17 19 1 0 0 0 0
  10030. 17 20 1 0 0 0 0
  10031. 20 21 1 0 0 0 0
  10032. 20 22 1 0 0 0 0
  10033. 20 23 1 0 0 0 0
  10034. 23 24 1 0 0 0 0
  10035. 23 25 1 0 0 0 0
  10036. 23 26 1 0 0 0 0
  10037. 26 27 1 0 0 0 0
  10038. 26 28 1 0 0 0 0
  10039. 26 29 1 0 0 0 0
  10040. 29 30 1 0 0 0 0
  10041. 29 31 1 0 0 0 0
  10042. 29 32 1 0 0 0 0
  10043. 32 33 1 0 0 0 0
  10044. 32 34 1 0 0 0 0
  10045. 32 35 1 0 0 0 0
  10046. 35 36 2 0 0 0 0
  10047. 35 37 1 0 0 0 0
  10048. 37 38 1 0 0 0 0
  10049. M END
  10050. $$$$
  10051. dan274.sdf
  10052. MOE2004 3D
  10053. 39 38 0 0 0 0 0 0 0 0999 V2000
  10054. -6.3770 -0.9450 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0
  10055. -6.1690 -1.7100 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0
  10056. -6.9950 -1.4000 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0
  10057. -6.9610 -0.1480 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0
  10058. -5.0890 -0.4000 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0
  10059. -5.3350 0.3370 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0
  10060. -4.5590 -1.2210 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0
  10061. -4.2040 0.2420 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0
  10062. -3.9260 -0.5080 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
  10063. -4.7830 1.0090 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0
  10064. -2.9400 0.9000 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0
  10065. -2.4530 1.4430 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
  10066. -3.2170 1.6480 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0
  10067. -1.9500 -0.1010 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0
  10068. -2.4080 -0.6170 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0
  10069. -1.7150 -0.8680 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0
  10070. -0.6630 0.5690 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0
  10071. -0.9100 1.2710 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0
  10072. 0.0180 -0.1690 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0
  10073. 0.0000 1.3340 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0
  10074. 0.6620 0.5690 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0
  10075. 0.9070 1.2690 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0
  10076. -0.0200 -0.1710 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0
  10077. 1.9500 -0.1000 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0
  10078. 2.4020 -0.6240 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0
  10079. 1.7170 -0.8600 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
  10080. 2.9440 0.9040 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0
  10081. 2.4610 1.4610 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0
  10082. 3.2220 1.6410 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0
  10083. 4.2060 0.2480 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0
  10084. 3.9270 -0.4930 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0
  10085. 4.7880 1.0190 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0
  10086. 5.0870 -0.4080 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0
  10087. 5.3310 0.3200 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0
  10088. 4.5540 -1.2330 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0
  10089. 6.3760 -0.9470 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0
  10090. 6.9620 -0.1460 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0
  10091. 6.1690 -1.7040 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0
  10092. 6.9910 -1.4100 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0
  10093. 1 2 1 0 0 0 0
  10094. 1 3 1 0 0 0 0
  10095. 1 4 1 0 0 0 0
  10096. 1 5 1 0 0 0 0
  10097. 5 6 1 0 0 0 0
  10098. 5 7 1 0 0 0 0
  10099. 5 8 1 0 0 0 0
  10100. 8 9 1 0 0 0 0
  10101. 8 10 1 0 0 0 0
  10102. 8 11 1 0 0 0 0
  10103. 11 12 1 0 0 0 0
  10104. 11 13 1 0 0 0 0
  10105. 11 14 1 0 0 0 0
  10106. 14 15 1 0 0 0 0
  10107. 14 16 1 0 0 0 0
  10108. 14 17 1 0 0 0 0
  10109. 17 18 1 0 0 0 0
  10110. 17 19 1 0 0 0 0
  10111. 17 20 1 0 0 0 0
  10112. 20 21 1 0 0 0 0
  10113. 21 22 1 0 0 0 0
  10114. 21 23 1 0 0 0 0
  10115. 21 24 1 0 0 0 0
  10116. 24 25 1 0 0 0 0
  10117. 24 26 1 0 0 0 0
  10118. 24 27 1 0 0 0 0
  10119. 27 28 1 0 0 0 0
  10120. 27 29 1 0 0 0 0
  10121. 27 30 1 0 0 0 0
  10122. 30 31 1 0 0 0 0
  10123. 30 32 1 0 0 0 0
  10124. 30 33 1 0 0 0 0
  10125. 33 34 1 0 0 0 0
  10126. 33 35 1 0 0 0 0
  10127. 33 36 1 0 0 0 0
  10128. 36 37 1 0 0 0 0
  10129. 36 38 1 0 0 0 0
  10130. 36 39 1 0 0 0 0
  10131. M END
  10132. $$$$
  10133. dan275.sdf
  10134. MOE2004 3D
  10135. 41 40 0 0 0 0 0 0 0 0999 V2000
  10136. 6.3560 -1.9790 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0
  10137. 7.2440 -1.4530 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
  10138. 6.4000 -3.0090 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
  10139. 6.4010 -2.0060 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0
  10140. 5.0820 -1.3010 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0
  10141. 4.2240 -1.8820 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0
  10142. 5.0580 -1.3160 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0
  10143. 4.9920 0.1400 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0
  10144. 5.9030 0.6790 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0
  10145. 4.9610 0.1480 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
  10146. 3.7880 0.9080 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0
  10147. 3.8300 0.9160 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
  10148. 3.8710 1.9520 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0
  10149. 2.4410 0.3450 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0
  10150. 2.4240 0.2800 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0
  10151. 2.3070 -0.6710 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0
  10152. 1.2800 1.2190 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0
  10153. 1.3020 1.2920 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0
  10154. 1.4000 2.2360 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0
  10155. -0.0690 0.6530 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0
  10156. -0.0900 0.5810 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0
  10157. -0.1770 -0.3630 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0
  10158. -1.2290 1.5290 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0
  10159. -1.2370 1.5700 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0
  10160. -1.0670 2.5560 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0
  10161. -2.5980 1.0640 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0
  10162. -3.3280 1.8370 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  10163. -2.5840 1.0010 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0
  10164. -3.0420 -0.2790 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0
  10165. -2.3120 -1.0520 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0
  10166. -3.0590 -0.2150 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0
  10167. -4.4090 -0.7450 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0
  10168. -4.3980 -0.8010 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0
  10169. -4.5750 -1.7700 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0
  10170. -5.5670 0.1390 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0
  10171. -5.5760 0.2630 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0
  10172. -5.4950 1.1440 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0
  10173. -6.8890 -0.4460 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0
  10174. -7.5010 -0.0810 -1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0
  10175. -7.3270 -1.4420 0.6470 O 0 0 0 0 0 0 0 0 0 0 0 0
  10176. -6.7350 -1.6400 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0
  10177. 1 2 1 0 0 0 0
  10178. 1 3 1 0 0 0 0
  10179. 1 4 1 0 0 0 0
  10180. 1 5 1 0 0 0 0
  10181. 5 6 1 0 0 0 0
  10182. 5 7 1 0 0 0 0
  10183. 5 8 1 0 0 0 0
  10184. 8 9 1 0 0 0 0
  10185. 8 10 1 0 0 0 0
  10186. 8 11 1 0 0 0 0
  10187. 11 12 1 0 0 0 0
  10188. 11 13 1 0 0 0 0
  10189. 11 14 1 0 0 0 0
  10190. 14 15 1 0 0 0 0
  10191. 14 16 1 0 0 0 0
  10192. 14 17 1 0 0 0 0
  10193. 17 18 1 0 0 0 0
  10194. 17 19 1 0 0 0 0
  10195. 17 20 1 0 0 0 0
  10196. 20 21 1 0 0 0 0
  10197. 20 22 1 0 0 0 0
  10198. 20 23 1 0 0 0 0
  10199. 23 24 1 0 0 0 0
  10200. 23 25 1 0 0 0 0
  10201. 23 26 1 0 0 0 0
  10202. 26 27 1 0 0 0 0
  10203. 26 28 1 0 0 0 0
  10204. 26 29 1 0 0 0 0
  10205. 29 30 1 0 0 0 0
  10206. 29 31 1 0 0 0 0
  10207. 29 32 1 0 0 0 0
  10208. 32 33 1 0 0 0 0
  10209. 32 34 1 0 0 0 0
  10210. 32 35 1 0 0 0 0
  10211. 35 36 1 0 0 0 0
  10212. 35 37 1 0 0 0 0
  10213. 35 38 1 0 0 0 0
  10214. 38 39 2 0 0 0 0
  10215. 38 40 1 0 0 0 0
  10216. 40 41 1 0 0 0 0
  10217. M END
  10218. $$$$
  10219. dan276.sdf
  10220. MOE2004 3D
  10221. 24 26 0 0 0 0 0 0 0 0999 V2000
  10222. -2.4760 1.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  10223. -2.4870 2.4830 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  10224. -3.6830 0.6970 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  10225. -4.6240 1.2400 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0
  10226. -3.6830 -0.6970 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  10227. -4.6240 -1.2400 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0
  10228. -2.4760 -1.3960 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  10229. -2.4870 -2.4830 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0
  10230. -1.2660 -0.6950 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
  10231. -1.2660 0.6950 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
  10232. 0.0000 1.4370 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
  10233. 1.2660 0.6950 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
  10234. 1.2660 -0.6950 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
  10235. 0.0000 -1.4370 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
  10236. 2.4760 1.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
  10237. 2.4870 2.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
  10238. 3.6830 0.6970 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  10239. 4.6240 1.2400 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0
  10240. 3.6830 -0.6970 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
  10241. 4.6240 -1.2400 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0
  10242. 2.4760 -1.3960 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
  10243. 2.4870 -2.4830 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
  10244. 0.0000 2.6630 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0
  10245. 0.0000 -2.6630 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0
  10246. 1 2 1 0 0 0 0
  10247. 1 3 1 0 0 0 0
  10248. 1 10 2 0 0 0 0
  10249. 3 4 1 0 0 0 0
  10250. 3 5 2 0 0 0 0
  10251. 5 6 1 0 0 0 0
  10252. 5 7 1 0 0 0 0
  10253. 7 8 1 0 0 0 0
  10254. 7 9 2 0 0 0 0
  10255. 9 10 1 0 0 0 0
  10256. 9 14 1 0 0 0 0
  10257. 10 11 1 0 0 0 0
  10258. 11 12 1 0 0 0 0
  10259. 11 23 2 0 0 0 0
  10260. 12 13 2 0 0 0 0
  10261. 12 15 1 0 0 0 0
  10262. 13 14 1 0 0 0 0
  10263. 13 21 1 0 0 0 0
  10264. 14 24 2 0 0 0 0
  10265. 15 16 1 0 0 0 0
  10266. 15 17 2 0 0 0 0
  10267. 17 18 1 0 0 0 0
  10268. 17 19 1 0 0 0 0
  10269. 19 20 1 0 0 0 0
  10270. 19 21 2 0 0 0 0
  10271. 21 22 1 0 0 0 0
  10272. M END
  10273. $$$$
  10274. dan277.sdf
  10275. MOE2004 3D
  10276. 37 37 0 0 0 0 0 0 0 0999 V2000
  10277. 1.7640 0.0660 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0
  10278. 1.2200 0.1390 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0
  10279. 3.0310 0.6510 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0
  10280. 3.4230 1.1610 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
  10281. 3.7660 0.5630 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0
  10282. 3.2550 -0.1000 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0
  10283. 3.8420 -0.1670 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0
  10284. 1.9880 -0.6830 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0
  10285. 1.6340 -1.1970 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0
  10286. 1.2010 -0.6070 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0
  10287. -0.2030 -1.2550 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0
  10288. -0.0720 -2.4270 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0
  10289. 0.7050 -3.1380 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0
  10290. -1.0110 -2.9870 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
  10291. 0.1850 -2.0810 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0
  10292. -0.6880 -1.8920 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0
  10293. -0.6760 -1.1850 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0
  10294. -1.7080 -2.2810 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0
  10295. -0.0570 -2.7380 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0
  10296. -1.2960 -0.2750 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0
  10297. -2.1640 -0.8840 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0
  10298. -0.9310 0.1170 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0
  10299. -1.8560 0.9380 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0
  10300. -2.9190 0.4960 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0
  10301. -3.6810 -0.1410 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0
  10302. -2.4920 -0.0520 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0
  10303. -3.4380 1.3610 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0
  10304. -2.5650 1.8800 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0
  10305. -3.3640 1.3600 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0
  10306. -3.0160 2.7410 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0
  10307. -1.8630 2.2740 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0
  10308. -0.7720 1.7530 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0
  10309. -0.0050 2.1050 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0
  10310. -1.2010 2.6400 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0
  10311. -0.2860 1.1770 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0
  10312. 5.0150 1.1220 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0
  10313. 5.2350 1.5480 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0
  10314. 1 2 1 0 0 0 0
  10315. 1 3 1 0 0 0 0
  10316. 1 10 2 0 0 0 0
  10317. 3 4 1 0 0 0 0
  10318. 3 5 2 0 0 0 0
  10319. 5 6 1 0 0 0 0
  10320. 5 36 1 0 0 0 0
  10321. 6 7 1 0 0 0 0
  10322. 6 8 2 0 0 0 0
  10323. 8 9 1 0 0 0 0
  10324. 8 10 1 0 0 0 0
  10325. 10 11 1 0 0 0 0
  10326. 11 12 1 0 0 0 0
  10327. 11 16 1 0 0 0 0
  10328. 11 20 1 0 0 0 0
  10329. 12 13 1 0 0 0 0
  10330. 12 14 1 0 0 0 0
  10331. 12 15 1 0 0 0 0
  10332. 16 17 1 0 0 0 0
  10333. 16 18 1 0 0 0 0
  10334. 16 19 1 0 0 0 0
  10335. 20 21 1 0 0 0 0
  10336. 20 22 1 0 0 0 0
  10337. 20 23 1 0 0 0 0
  10338. 23 24 1 0 0 0 0
  10339. 23 28 1 0 0 0 0
  10340. 23 32 1 0 0 0 0
  10341. 24 25 1 0 0 0 0
  10342. 24 26 1 0 0 0 0
  10343. 24 27 1 0 0 0 0
  10344. 28 29 1 0 0 0 0
  10345. 28 30 1 0 0 0 0
  10346. 28 31 1 0 0 0 0
  10347. 32 33 1 0 0 0 0
  10348. 32 34 1 0 0 0 0
  10349. 32 35 1 0 0 0 0
  10350. 36 37 1 0 0 0 0
  10351. M END
  10352. $$$$