/data/set3/all.sdf
Unknown | 3343 lines | 3278 code | 65 blank | 0 comment | 0 complexity | c6a2c904fc229541a94743a3f4fdd3bc MD5 | raw file
- dan001.hin
- OpenBabel0803D
- 5 4 0 0 0 0 0 0 0 0999 V2000
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- 1 2 1 0 0 0
- 1 3 1 0 0 0
- 1 4 1 0 0 0
- 1 5 1 0 0 0
- M END
- $$$$
- dan002.hin
- OpenBabel0803D
- 8 7 0 0 0 0 0 0 0 0999 V2000
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- 2 8 1 0 0 0
- M END
- $$$$
- dan003.hin
- OpenBabel0803D
- 11 10 0 0 0 0 0 0 0 0999 V2000
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- M END
- $$$$
- dan004.hin
- OpenBabel0803D
- 14 13 0 0 0 0 0 0 0 0999 V2000
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- 4 14 1 0 0 0
- M END
- $$$$
- dan005.hin
- OpenBabel0803D
- 14 13 0 0 0 0 0 0 0 0999 V2000
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- M END
- $$$$
- dan006.hin
- OpenBabel0803D
- 17 16 0 0 0 0 0 0 0 0999 V2000
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- M END
- $$$$
- dan007.hin
- OpenBabel0803D
- 17 16 0 0 0 0 0 0 0 0999 V2000
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- M END
- $$$$
- dan008.hin
- OpenBabel0803D
- 17 16 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5266 0.0000 0.0000 C 0 0 0 0 0
- 2.0356 1.4393 0.0000 C 0 0 0 0 0
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- M END
- $$$$
- dan009.hin
- OpenBabel0803D
- 20 19 0 0 0 0 0 0 0 0999 V2000
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- M END
- $$$$
- dan010.hin
- OpenBabel0803D
- 20 19 0 0 0 0 0 0 0 0999 V2000
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- 6 19 1 0 0 0
- M END
- $$$$
- dan011.hin
- OpenBabel0803D
- 20 19 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5130 0.0000 0.0000 C 0 0 0 0 0
- 2.0766 1.4242 0.0000 C 0 0 0 0 0
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- 6 20 1 0 0 0
- M END
- $$$$
- dan012.hin
- OpenBabel0803D
- 20 19 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5134 0.0000 0.0000 C 0 0 0 0 0
- 2.0954 1.4253 0.0000 C 0 0 0 0 0
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- M END
- $$$$
- dan013.hin
- OpenBabel0803D
- 20 19 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5214 0.0000 0.0000 C 0 0 0 0 0
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- M END
- $$$$
- dan014.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0690 1.4147 0.0000 C 0 0 0 0 0
- 3.5890 1.4124 0.0005 C 0 0 0 0 0
- 4.1441 2.8274 -0.0002 C 0 0 0 0 0
- 5.6645 2.8271 0.0023 C 0 0 0 0 0
- 6.2186 4.2339 0.0008 C 0 0 0 0 0
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- 1.6910 1.9687 -0.8829 H 0 0 0 0 0
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- M END
- $$$$
- dan015.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
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- M END
- $$$$
- dan016.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5109 0.0000 0.0000 C 0 0 0 0 0
- 2.0738 1.4133 0.0000 C 0 0 0 0 0
- 3.5945 1.4136 0.1786 C 0 0 0 0 0
- 4.1469 2.8247 -0.0310 C 0 0 0 0 0
- 5.6489 2.8390 -0.2079 C 0 0 0 0 0
- 3.9596 0.8740 1.5532 C 0 0 0 0 0
- -0.3981 -1.0226 -0.0080 H 0 0 0 0 0
- -0.4062 0.5033 0.8875 H 0 0 0 0 0
- -0.4038 0.5169 -0.8807 H 0 0 0 0 0
- 1.9023 -0.5451 0.8893 H 0 0 0 0 0
- 1.8913 -0.5575 -0.8786 H 0 0 0 0 0
- 1.8018 1.9226 -0.9463 H 0 0 0 0 0
- 1.6031 2.0105 0.8071 H 0 0 0 0 0
- 4.0381 0.7413 -0.5973 H 0 0 0 0 0
- 3.6706 3.2791 -0.9234 H 0 0 0 0 0
- 3.8579 3.4717 0.8214 H 0 0 0 0 0
- 6.0178 3.8588 -0.3767 H 0 0 0 0 0
- 6.1689 2.4458 0.6764 H 0 0 0 0 0
- 5.9623 2.2303 -1.0667 H 0 0 0 0 0
- 5.0385 0.6985 1.6488 H 0 0 0 0 0
- 3.6641 1.5647 2.3543 H 0 0 0 0 0
- 3.4427 -0.0830 1.7371 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 8 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 11 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 13 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 7 1 0 0 0
- 4 15 1 0 0 0
- 5 6 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- M END
- $$$$
- dan017.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5094 0.0000 0.0000 C 0 0 0 0 0
- 2.0770 1.4118 0.0000 C 0 0 0 0 0
- 3.6161 1.4229 0.0031 C 0 0 0 0 0
- 4.1066 2.8695 0.0026 C 0 0 0 0 0
- 4.1328 0.7176 1.2559 C 0 0 0 0 0
- 4.1376 0.7152 -1.2464 C 0 0 0 0 0
- -0.3975 -1.0228 0.0026 H 0 0 0 0 0
- -0.4048 0.5125 0.8828 H 0 0 0 0 0
- -0.4046 0.5078 -0.8856 H 0 0 0 0 0
- 1.9072 -0.5502 0.8827 H 0 0 0 0 0
- 1.9074 -0.5503 -0.8825 H 0 0 0 0 0
- 1.7067 1.9663 -0.8856 H 0 0 0 0 0
- 1.7030 1.9680 0.8831 H 0 0 0 0 0
- 5.2035 2.9142 0.0059 H 0 0 0 0 0
- 3.7558 3.4133 -0.8846 H 0 0 0 0 0
- 3.7503 3.4158 0.8862 H 0 0 0 0 0
- 5.2199 0.5731 1.2221 H 0 0 0 0 0
- 3.9019 1.2934 2.1620 H 0 0 0 0 0
- 3.6586 -0.2716 1.3676 H 0 0 0 0 0
- 5.2243 0.5689 -1.2071 H 0 0 0 0 0
- 3.6622 -0.2734 -1.3590 H 0 0 0 0 0
- 3.9122 1.2899 -2.1545 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 8 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 11 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 13 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 7 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- M END
- $$$$
- dan018.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0971 1.4162 0.0000 C 0 0 0 0 0
- 3.5707 1.4101 0.4564 C 0 0 0 0 0
- 4.1489 2.8182 0.4545 C 0 0 0 0 0
- 3.7238 0.8136 1.8476 C 0 0 0 0 0
- 1.9713 2.0292 -1.3881 C 0 0 0 0 0
- -0.3953 -1.0239 0.0084 H 0 0 0 0 0
- -0.4064 0.5157 0.8804 H 0 0 0 0 0
- -0.4094 0.5009 -0.8880 H 0 0 0 0 0
- 1.8812 -0.5533 0.8928 H 0 0 0 0 0
- 1.8935 -0.5656 -0.8735 H 0 0 0 0 0
- 1.5187 2.0426 0.7237 H 0 0 0 0 0
- 4.1485 0.7840 -0.2672 H 0 0 0 0 0
- 5.2291 2.8053 0.6455 H 0 0 0 0 0
- 3.9823 3.3151 -0.5151 H 0 0 0 0 0
- 3.6840 3.4479 1.2251 H 0 0 0 0 0
- 4.7805 0.7362 2.1324 H 0 0 0 0 0
- 3.2194 1.4243 2.6086 H 0 0 0 0 0
- 3.2870 -0.1969 1.8985 H 0 0 0 0 0
- 2.4663 3.0132 -1.4323 H 0 0 0 0 0
- 2.4386 1.3977 -2.1559 H 0 0 0 0 0
- 0.9201 2.1698 -1.6710 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 8 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 11 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 7 1 0 0 0
- 3 13 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 14 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- M END
- $$$$
- dan019.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5217 0.0000 0.0000 C 0 0 0 0 0
- 2.0505 1.4383 0.0000 C 0 0 0 0 0
- 3.4380 1.5801 -0.6346 C 0 0 0 0 0
- 3.6205 2.9853 -1.1893 C 0 0 0 0 0
- 4.5461 1.2748 0.3603 C 0 0 0 0 0
- 2.0335 -0.7880 1.1949 C 0 0 0 0 0
- -0.3976 -1.0230 0.0276 H 0 0 0 0 0
- -0.4037 0.5326 0.8716 H 0 0 0 0 0
- -0.4048 0.4848 -0.8981 H 0 0 0 0 0
- 1.8706 -0.5076 -0.9336 H 0 0 0 0 0
- 1.3369 2.0797 -0.5582 H 0 0 0 0 0
- 2.0607 1.8409 1.0328 H 0 0 0 0 0
- 3.5166 0.8566 -1.4839 H 0 0 0 0 0
- 4.6189 3.1132 -1.6279 H 0 0 0 0 0
- 2.8865 3.2090 -1.9746 H 0 0 0 0 0
- 3.5062 3.7464 -0.4058 H 0 0 0 0 0
- 5.5340 1.3215 -0.1156 H 0 0 0 0 0
- 4.5490 1.9879 1.1957 H 0 0 0 0 0
- 4.4298 0.2665 0.7896 H 0 0 0 0 0
- 3.1350 -0.7900 1.2292 H 0 0 0 0 0
- 1.6772 -0.3637 2.1433 H 0 0 0 0 0
- 1.7004 -1.8331 1.1565 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 8 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 7 1 0 0 0
- 2 11 1 0 0 0
- 3 4 1 0 0 0
- 3 12 1 0 0 0
- 3 13 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 14 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- M END
- $$$$
- dan020.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5123 0.0000 0.0000 C 0 0 0 0 0
- 2.1513 1.4011 0.0000 C 0 0 0 0 0
- 3.6849 1.2213 0.0009 C 0 0 0 0 0
- 4.4243 2.5417 0.0012 C 0 0 0 0 0
- 1.7416 2.1737 -1.2530 C 0 0 0 0 0
- 1.7400 2.1744 1.2521 C 0 0 0 0 0
- -0.3909 -1.0258 0.0023 H 0 0 0 0 0
- -0.4102 0.5080 0.8834 H 0 0 0 0 0
- -0.4098 0.5039 -0.8860 H 0 0 0 0 0
- 1.8775 -0.5626 0.8835 H 0 0 0 0 0
- 1.8774 -0.5625 -0.8835 H 0 0 0 0 0
- 3.9839 0.6240 0.8852 H 0 0 0 0 0
- 3.9848 0.6245 -0.8834 H 0 0 0 0 0
- 5.5106 2.4005 0.0012 H 0 0 0 0 0
- 4.1527 3.1413 -0.8834 H 0 0 0 0 0
- 4.1526 3.1413 0.8859 H 0 0 0 0 0
- 2.3802 3.0632 -1.3856 H 0 0 0 0 0
- 1.8484 1.5573 -2.1554 H 0 0 0 0 0
- 0.6989 2.5134 -1.2049 H 0 0 0 0 0
- 2.3803 3.0624 1.3868 H 0 0 0 0 0
- 0.6983 2.5167 1.2012 H 0 0 0 0 0
- 1.8430 1.5573 2.1544 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 8 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 11 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 6 1 0 0 0
- 3 7 1 0 0 0
- 4 5 1 0 0 0
- 4 13 1 0 0 0
- 4 14 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- M END
- $$$$
- dan021.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5130 0.0000 0.0000 C 0 0 0 0 0
- 2.0863 1.4214 0.0000 C 0 0 0 0 0
- 3.6043 1.3838 0.2251 C 0 0 0 0 0
- 4.0565 2.3879 1.2629 C 0 0 0 0 0
- 1.7217 2.1252 -1.3105 C 0 0 0 0 0
- 1.9537 3.6176 -1.2643 C 0 0 0 0 0
- -0.4026 -1.0123 -0.1248 H 0 0 0 0 0
- -0.4070 0.4055 0.9355 H 0 0 0 0 0
- -0.3898 0.6230 -0.8228 H 0 0 0 0 0
- 1.8844 -0.5532 0.8857 H 0 0 0 0 0
- 1.8932 -0.5547 -0.8809 H 0 0 0 0 0
- 1.6071 1.9818 0.8419 H 0 0 0 0 0
- 3.9226 0.3696 0.5418 H 0 0 0 0 0
- 4.1389 1.5684 -0.7288 H 0 0 0 0 0
- 5.1461 2.3621 1.3928 H 0 0 0 0 0
- 3.7835 3.4145 0.9804 H 0 0 0 0 0
- 3.6054 2.1897 2.2444 H 0 0 0 0 0
- 2.2874 1.6780 -2.1523 H 0 0 0 0 0
- 0.6489 1.9181 -1.5316 H 0 0 0 0 0
- 1.6248 4.0982 -2.1945 H 0 0 0 0 0
- 1.4054 4.0895 -0.4378 H 0 0 0 0 0
- 3.0173 3.8594 -1.1289 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 8 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 11 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 6 1 0 0 0
- 3 13 1 0 0 0
- 4 5 1 0 0 0
- 4 14 1 0 0 0
- 4 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 5 18 1 0 0 0
- 6 7 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- M END
- $$$$
- dan022.hin
- OpenBabel0803D
- 23 22 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5213 0.0000 0.0000 C 0 0 0 0 0
- 2.1122 1.4360 0.0000 C 0 0 0 0 0
- 3.6379 1.3448 -0.0771 C 0 0 0 0 0
- 1.6066 2.2067 -1.2191 C 0 0 0 0 0
- 1.7108 2.1809 1.2725 C 0 0 0 0 0
- 2.0370 -0.8008 1.1867 C 0 0 0 0 0
- -0.3968 -0.9987 -0.2210 H 0 0 0 0 0
- -0.4098 0.3089 0.9715 H 0 0 0 0 0
- -0.3939 0.6978 -0.7573 H 0 0 0 0 0
- 1.8691 -0.4943 -0.9411 H 0 0 0 0 0
- 4.1083 2.3286 0.0458 H 0 0 0 0 0
- 4.0304 0.6777 0.7081 H 0 0 0 0 0
- 3.9681 0.9386 -1.0426 H 0 0 0 0 0
- 1.9123 3.2596 -1.1792 H 0 0 0 0 0
- 1.9938 1.7820 -2.1549 H 0 0 0 0 0
- 0.5058 2.1733 -1.2766 H 0 0 0 0 0
- 2.2916 3.1028 1.4042 H 0 0 0 0 0
- 0.6486 2.4600 1.2563 H 0 0 0 0 0
- 1.8703 1.5456 2.1597 H 0 0 0 0 0
- 3.1369 -0.8686 1.1637 H 0 0 0 0 0
- 1.7681 -0.3071 2.1357 H 0 0 0 0 0
- 1.6283 -1.8174 1.1990 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 8 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 7 1 0 0 0
- 2 11 1 0 0 0
- 3 4 1 0 0 0
- 3 5 1 0 0 0
- 3 6 1 0 0 0
- 4 12 1 0 0 0
- 4 13 1 0 0 0
- 4 14 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- M END
- $$$$
- dan023.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0692 1.4146 0.0000 C 0 0 0 0 0
- 3.5892 1.4119 0.0024 C 0 0 0 0 0
- 4.1448 2.8269 0.0033 C 0 0 0 0 0
- 5.6648 2.8239 0.0082 C 0 0 0 0 0
- 6.2225 4.2382 0.0101 C 0 0 0 0 0
- 7.7345 4.2372 0.0168 C 0 0 0 0 0
- -0.3985 -1.0225 0.0008 H 0 0 0 0 0
- -0.4052 0.5109 0.8836 H 0 0 0 0 0
- -0.4050 0.5094 -0.8846 H 0 0 0 0 0
- 1.8904 -0.5539 0.8822 H 0 0 0 0 0
- 1.8903 -0.5537 -0.8823 H 0 0 0 0 0
- 1.6924 1.9682 -0.8836 H 0 0 0 0 0
- 1.6894 1.9696 0.8814 H 0 0 0 0 0
- 3.9653 0.8569 0.8855 H 0 0 0 0 0
- 3.9680 0.8572 -0.8797 H 0 0 0 0 0
- 3.7702 3.3810 -0.8810 H 0 0 0 0 0
- 3.7643 3.3823 0.8843 H 0 0 0 0 0
- 6.0400 2.2691 0.8918 H 0 0 0 0 0
- 6.0455 2.2694 -0.8732 H 0 0 0 0 0
- 5.8484 4.7916 -0.8742 H 0 0 0 0 0
- 5.8403 4.7926 0.8903 H 0 0 0 0 0
- 8.1339 5.2594 0.0194 H 0 0 0 0 0
- 8.1353 3.7258 0.9022 H 0 0 0 0 0
- 8.1429 3.7274 -0.8660 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 16 1 0 0 0
- 4 17 1 0 0 0
- 5 6 1 0 0 0
- 5 18 1 0 0 0
- 5 19 1 0 0 0
- 6 7 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan024.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0690 1.4146 0.0000 C 0 0 0 0 0
- 3.5878 1.4117 0.0082 C 0 0 0 0 0
- 4.1500 2.8248 -0.0085 C 0 0 0 0 0
- 5.6668 2.8253 0.1906 C 0 0 0 0 0
- 6.2288 4.2205 -0.0220 C 0 0 0 0 0
- 6.0239 2.3128 1.5769 C 0 0 0 0 0
- -0.3986 -1.0225 0.0013 H 0 0 0 0 0
- -0.4053 0.5114 0.8833 H 0 0 0 0 0
- -0.4049 0.5089 -0.8849 H 0 0 0 0 0
- 1.8907 -0.5534 0.8823 H 0 0 0 0 0
- 1.8902 -0.5540 -0.8821 H 0 0 0 0 0
- 1.6972 1.9674 -0.8861 H 0 0 0 0 0
- 1.6851 1.9708 0.8790 H 0 0 0 0 0
- 3.9739 0.8791 0.9081 H 0 0 0 0 0
- 3.9720 0.8403 -0.8604 H 0 0 0 0 0
- 3.8965 3.3213 -0.9663 H 0 0 0 0 0
- 3.6696 3.4365 0.7820 H 0 0 0 0 0
- 6.1200 2.1405 -0.5680 H 0 0 0 0 0
- 7.3163 4.2368 0.1270 H 0 0 0 0 0
- 6.0288 4.5838 -1.0385 H 0 0 0 0 0
- 5.7904 4.9446 0.6780 H 0 0 0 0 0
- 7.1032 2.1491 1.6816 H 0 0 0 0 0
- 5.7176 3.0171 2.3618 H 0 0 0 0 0
- 5.5114 1.3563 1.7745 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 16 1 0 0 0
- 4 17 1 0 0 0
- 5 6 1 0 0 0
- 5 18 1 0 0 0
- 5 19 1 0 0 0
- 6 7 1 0 0 0
- 6 8 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan025.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0681 1.4137 0.0000 C 0 0 0 0 0
- 3.5889 1.4178 0.0197 C 0 0 0 0 0
- 4.1486 2.8317 -0.1602 C 0 0 0 0 0
- 5.6608 2.8302 0.0709 C 0 0 0 0 0
- 6.2227 4.2238 0.2430 C 0 0 0 0 0
- 3.7996 3.3598 -1.5433 C 0 0 0 0 0
- -0.3986 -1.0224 -0.0010 H 0 0 0 0 0
- -0.4055 0.5095 0.8843 H 0 0 0 0 0
- -0.4045 0.5110 -0.8838 H 0 0 0 0 0
- 1.8913 -0.5526 0.8826 H 0 0 0 0 0
- 1.8899 -0.5545 -0.8820 H 0 0 0 0 0
- 1.7142 1.9721 -0.8972 H 0 0 0 0 0
- 1.6756 1.9759 0.8709 H 0 0 0 0 0
- 3.9513 0.9838 0.9733 H 0 0 0 0 0
- 3.9831 0.7569 -0.7787 H 0 0 0 0 0
- 3.6746 3.4958 0.6048 H 0 0 0 0 0
- 5.8963 2.2283 0.9720 H 0 0 0 0 0
- 6.1685 2.3165 -0.7700 H 0 0 0 0 0
- 7.3032 4.1941 0.4332 H 0 0 0 0 0
- 6.0655 4.8415 -0.6518 H 0 0 0 0 0
- 5.7552 4.7488 1.0868 H 0 0 0 0 0
- 4.0330 4.4274 -1.6428 H 0 0 0 0 0
- 4.3449 2.8266 -2.3334 H 0 0 0 0 0
- 2.7223 3.2282 -1.7412 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 16 1 0 0 0
- 4 17 1 0 0 0
- 5 6 1 0 0 0
- 5 8 1 0 0 0
- 5 18 1 0 0 0
- 6 7 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan026.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5109 0.0000 0.0000 C 0 0 0 0 0
- 2.0737 1.4134 0.0000 C 0 0 0 0 0
- 3.5942 1.4137 0.1808 C 0 0 0 0 0
- 4.1458 2.8243 -0.0306 C 0 0 0 0 0
- 5.6570 2.8361 -0.2011 C 0 0 0 0 0
- 6.1765 4.2396 -0.4179 C 0 0 0 0 0
- 3.9567 0.8768 1.5573 C 0 0 0 0 0
- -0.3981 -1.0226 -0.0078 H 0 0 0 0 0
- -0.4062 0.5035 0.8875 H 0 0 0 0 0
- -0.4038 0.5167 -0.8808 H 0 0 0 0 0
- 1.9022 -0.5449 0.8894 H 0 0 0 0 0
- 1.8913 -0.5576 -0.8785 H 0 0 0 0 0
- 1.8030 1.9221 -0.9470 H 0 0 0 0 0
- 1.6018 2.0111 0.8060 H 0 0 0 0 0
- 4.0380 0.7390 -0.5930 H 0 0 0 0 0
- 3.6749 3.2780 -0.9268 H 0 0 0 0 0
- 3.8547 3.4751 0.8188 H 0 0 0 0 0
- 6.1424 2.3867 0.6888 H 0 0 0 0 0
- 5.9459 2.1901 -1.0541 H 0 0 0 0 0
- 7.2673 4.2464 -0.5381 H 0 0 0 0 0
- 5.7445 4.6972 -1.3179 H 0 0 0 0 0
- 5.9354 4.8962 0.4287 H 0 0 0 0 0
- 5.0358 0.7033 1.6559 H 0 0 0 0 0
- 3.6582 1.5684 2.3564 H 0 0 0 0 0
- 3.4407 -0.0808 1.7413 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 8 1 0 0 0
- 4 16 1 0 0 0
- 5 6 1 0 0 0
- 5 17 1 0 0 0
- 5 18 1 0 0 0
- 6 7 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan027.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0672 1.4125 0.0000 C 0 0 0 0 0
- 3.5884 1.4219 -0.0048 C 0 0 0 0 0
- 4.1624 2.8501 -0.0021 C 0 0 0 0 0
- 5.6881 2.7764 -0.0077 C 0 0 0 0 0
- 3.6908 3.5959 -1.2492 C 0 0 0 0 0
- 3.6997 3.5877 1.2532 C 0 0 0 0 0
- -0.3987 -1.0224 0.0031 H 0 0 0 0 0
- -0.4050 0.5131 0.8824 H 0 0 0 0 0
- -0.4048 0.5076 -0.8857 H 0 0 0 0 0
- 1.8911 -0.5533 0.8822 H 0 0 0 0 0
- 1.8907 -0.5531 -0.8825 H 0 0 0 0 0
- 1.6962 1.9845 -0.8810 H 0 0 0 0 0
- 1.7015 1.9822 0.8848 H 0 0 0 0 0
- 3.9722 0.8696 0.8765 H 0 0 0 0 0
- 3.9664 0.8757 -0.8923 H 0 0 0 0 0
- 6.1316 3.7807 -0.0037 H 0 0 0 0 0
- 6.0689 2.2427 0.8733 H 0 0 0 0 0
- 6.0627 2.2527 -0.8974 H 0 0 0 0 0
- 3.9543 4.6602 -1.2102 H 0 0 0 0 0
- 4.1389 3.1756 -2.1593 H 0 0 0 0 0
- 2.5963 3.5172 -1.3575 H 0 0 0 0 0
- 3.9634 4.6521 1.2197 H 0 0 0 0 0
- 2.6059 3.5086 1.3685 H 0 0 0 0 0
- 4.1540 3.1608 2.1572 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 16 1 0 0 0
- 4 17 1 0 0 0
- 5 6 1 0 0 0
- 5 7 1 0 0 0
- 5 8 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan028.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5109 0.0000 0.0000 C 0 0 0 0 0
- 2.0734 1.4124 0.0000 C 0 0 0 0 0
- 3.5984 1.4124 0.1557 C 0 0 0 0 0
- 4.1666 2.8176 -0.1201 C 0 0 0 0 0
- 5.6662 2.8794 0.1257 C 0 0 0 0 0
- 3.8766 3.2414 -1.5535 C 0 0 0 0 0
- 3.9622 0.9154 1.5472 C 0 0 0 0 0
- -0.3981 -1.0226 -0.0049 H 0 0 0 0 0
- -0.4063 0.5060 0.8860 H 0 0 0 0 0
- -0.4037 0.5143 -0.8823 H 0 0 0 0 0
- 1.9024 -0.5419 0.8912 H 0 0 0 0 0
- 1.8913 -0.5589 -0.8777 H 0 0 0 0 0
- 1.7951 1.9361 -0.9421 H 0 0 0 0 0
- 1.6137 2.0053 0.8165 H 0 0 0 0 0
- 4.0326 0.7095 -0.5983 H 0 0 0 0 0
- 3.6630 3.5357 0.5734 H 0 0 0 0 0
- 6.0749 3.8539 -0.1732 H 0 0 0 0 0
- 5.9114 2.7349 1.1864 H 0 0 0 0 0
- 6.2018 2.1085 -0.4445 H 0 0 0 0 0
- 4.1519 4.2896 -1.7248 H 0 0 0 0 0
- 4.4335 2.6306 -2.2764 H 0 0 0 0 0
- 2.8051 3.1321 -1.7885 H 0 0 0 0 0
- 5.0283 0.6682 1.6295 H 0 0 0 0 0
- 3.7329 1.6611 2.3198 H 0 0 0 0 0
- 3.3886 0.0032 1.7854 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 8 1 0 0 0
- 4 16 1 0 0 0
- 5 6 1 0 0 0
- 5 7 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan029.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5133 0.0000 0.0000 C 0 0 0 0 0
- 2.0766 1.4245 0.0000 C 0 0 0 0 0
- 3.5993 1.4099 0.1882 C 0 0 0 0 0
- 4.0852 2.3729 1.2745 C 0 0 0 0 0
- 5.5432 2.0882 1.6032 C 0 0 0 0 0
- 3.9242 3.8240 0.8520 C 0 0 0 0 0
- 1.6904 2.1346 -1.2893 C 0 0 0 0 0
- -0.4036 -1.0068 -0.1603 H 0 0 0 0 0
- -0.4067 0.3725 0.9492 H 0 0 0 0 0
- -0.3885 0.6533 -0.7997 H 0 0 0 0 0
- 1.8876 -0.5539 0.8838 H 0 0 0 0 0
- 1.8939 -0.5510 -0.8830 H 0 0 0 0 0
- 1.6057 1.9733 0.8542 H 0 0 0 0 0
- 3.9373 0.3857 0.4508 H 0 0 0 0 0
- 4.1105 1.6452 -0.7678 H 0 0 0 0 0
- 3.4783 2.2033 2.1982 H 0 0 0 0 0
- 5.9156 2.7661 2.3825 H 0 0 0 0 0
- 5.6823 1.0618 1.9673 H 0 0 0 0 0
- 6.1875 2.2149 0.7227 H 0 0 0 0 0
- 4.2947 4.5079 1.6268 H 0 0 0 0 0
- 4.4785 4.0405 -0.0714 H 0 0 0 0 0
- 2.8705 4.0748 0.6680 H 0 0 0 0 0
- 1.9572 3.1988 -1.2591 H 0 0 0 0 0
- 2.1853 1.6934 -2.1650 H 0 0 0 0 0
- 0.6029 2.0574 -1.4564 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 8 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 15 1 0 0 0
- 4 16 1 0 0 0
- 5 6 1 0 0 0
- 5 7 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan030.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5209 0.0000 0.0000 C 0 0 0 0 0
- 2.0441 1.4361 0.0000 C 0 0 0 0 0
- 3.5168 1.5258 -0.3707 C 0 0 0 0 0
- 3.9574 2.9794 -0.5549 C 0 0 0 0 0
- 5.4648 3.0584 -0.7260 C 0 0 0 0 0
- 3.2532 3.6049 -1.7485 C 0 0 0 0 0
- 2.0407 -0.7780 1.1981 C 0 0 0 0 0
- -0.3982 -1.0231 0.0081 H 0 0 0 0 0
- -0.4037 0.5165 0.8812 H 0 0 0 0 0
- -0.4030 0.5028 -0.8889 H 0 0 0 0 0
- 1.8725 -0.5074 -0.9321 H 0 0 0 0 0
- 1.4623 2.0537 -0.7236 H 0 0 0 0 0
- 1.8714 1.9008 0.9915 H 0 0 0 0 0
- 4.1374 1.0432 0.4114 H 0 0 0 0 0
- 3.7135 0.9562 -1.3019 H 0 0 0 0 0
- 3.6739 3.5508 0.3633 H 0 0 0 0 0
- 5.7944 4.0963 -0.8642 H 0 0 0 0 0
- 5.9907 2.6584 0.1508 H 0 0 0 0 0
- 5.8033 2.4870 -1.6009 H 0 0 0 0 0
- 3.4286 4.6863 -1.7999 H 0 0 0 0 0
- 3.5946 3.1682 -2.6964 H 0 0 0 0 0
- 2.1651 3.4370 -1.6817 H 0 0 0 0 0
- 3.1386 -0.8079 1.2126 H 0 0 0 0 0
- 1.7121 -0.3295 2.1455 H 0 0 0 0 0
- 1.6829 -1.8157 1.1846 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 8 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 13 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 15 1 0 0 0
- 4 16 1 0 0 0
- 5 6 1 0 0 0
- 5 7 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan031.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5096 0.0000 0.0000 C 0 0 0 0 0
- 2.0757 1.4124 0.0000 C 0 0 0 0 0
- 3.6192 1.4365 -0.0016 C 0 0 0 0 0
- 4.0644 2.9112 0.0009 C 0 0 0 0 0
- 5.5627 3.1155 -0.0070 C 0 0 0 0 0
- 4.1333 0.7244 1.2487 C 0 0 0 0 0
- 4.1304 0.7291 -1.2558 C 0 0 0 0 0
- -0.3973 -1.0229 0.0031 H 0 0 0 0 0
- -0.4051 0.5127 0.8826 H 0 0 0 0 0
- -0.4048 0.5073 -0.8859 H 0 0 0 0 0
- 1.9061 -0.5510 0.8827 H 0 0 0 0 0
- 1.9057 -0.5504 -0.8833 H 0 0 0 0 0
- 1.6977 1.9645 -0.8841 H 0 0 0 0 0
- 1.6993 1.9642 0.8850 H 0 0 0 0 0
- 3.6219 3.4224 -0.8784 H 0 0 0 0 0
- 3.6315 3.4162 0.8886 H 0 0 0 0 0
- 5.8116 4.1847 0.0049 H 0 0 0 0 0
- 6.0438 2.6583 0.8684 H 0 0 0 0 0
- 6.0310 2.6812 -0.9008 H 0 0 0 0 0
- 5.2143 0.5390 1.2017 H 0 0 0 0 0
- 3.9365 1.3144 2.1537 H 0 0 0 0 0
- 3.6303 -0.2488 1.3759 H 0 0 0 0 0
- 5.2108 0.5402 -1.2101 H 0 0 0 0 0
- 3.6244 -0.2421 -1.3873 H 0 0 0 0 0
- 3.9351 1.3239 -2.1578 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 7 1 0 0 0
- 4 8 1 0 0 0
- 5 6 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan032.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5119 0.0000 0.0000 C 0 0 0 0 0
- 2.0703 1.4251 0.0000 C 0 0 0 0 0
- 3.5834 1.4592 0.2793 C 0 0 0 0 0
- 4.3866 0.7042 -0.7825 C 0 0 0 0 0
- 5.8680 0.9767 -0.6506 C 0 0 0 0 0
- 3.8881 0.9084 1.6638 C 0 0 0 0 0
- 1.7495 2.1186 -1.3151 C 0 0 0 0 0
- -0.3816 0.6362 -0.8167 H 0 0 0 0 0
- -0.4093 0.3933 0.9395 H 0 0 0 0 0
- -0.4040 -1.0096 -0.1400 H 0 0 0 0 0
- 1.8889 -0.5536 -0.8834 H 0 0 0 0 0
- 1.9098 -0.5421 0.8874 H 0 0 0 0 0
- 1.5690 1.9860 0.8285 H 0 0 0 0 0
- 3.9010 2.5317 0.2462 H 0 0 0 0 0
- 4.0163 0.9986 -1.7904 H 0 0 0 0 0
- 4.1945 -0.3844 -0.6987 H 0 0 0 0 0
- 6.1991 0.7931 0.3859 H 0 0 0 0 0
- 6.1157 2.0181 -0.8936 H 0 0 0 0 0
- 6.4578 0.3328 -1.3137 H 0 0 0 0 0
- 3.3925 -0.0649 1.8171 H 0 0 0 0 0
- 3.5425 1.5834 2.4558 H 0 0 0 0 0
- 4.9738 0.7621 1.7869 H 0 0 0 0 0
- 0.7013 1.9317 -1.6005 H 0 0 0 0 0
- 2.3965 1.7429 -2.1255 H 0 0 0 0 0
- 1.8974 3.2032 -1.2502 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 8 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 7 1 0 0 0
- 4 15 1 0 0 0
- 5 6 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan033.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5111 0.0000 0.0000 C 0 0 0 0 0
- 2.0723 1.4135 0.0000 C 0 0 0 0 0
- 3.6026 1.4276 0.0948 C 0 0 0 0 0
- 4.1088 2.8563 -0.1360 C 0 0 0 0 0
- 5.5287 2.9035 -0.6543 C 0 0 0 0 0
- 4.0473 0.8684 1.4512 C 0 0 0 0 0
- 5.4513 0.3088 1.4331 C 0 0 0 0 0
- -0.3980 -1.0227 -0.0010 H 0 0 0 0 0
- -0.4060 0.5093 0.8842 H 0 0 0 0 0
- -0.4043 0.5108 -0.8841 H 0 0 0 0 0
- 1.8997 -0.5444 0.8905 H 0 0 0 0 0
- 1.8917 -0.5580 -0.8782 H 0 0 0 0 0
- 1.7485 1.9388 -0.9215 H 0 0 0 0 0
- 1.6412 1.9926 0.8415 H 0 0 0 0 0
- 4.0075 0.7693 -0.7139 H 0 0 0 0 0
- 3.4465 3.3717 -0.8619 H 0 0 0 0 0
- 4.0278 3.4422 0.8016 H 0 0 0 0 0
- 5.8685 3.9383 -0.7880 H 0 0 0 0 0
- 6.2304 2.4116 0.0393 H 0 0 0 0 0
- 5.6245 2.3980 -1.6244 H 0 0 0 0 0
- 3.9582 1.6498 2.2320 H 0 0 0 0 0
- 3.3391 0.0627 1.7544 H 0 0 0 0 0
- 5.7432 -0.0630 2.4233 H 0 0 0 0 0
- 5.5467 -0.5265 0.7267 H 0 0 0 0 0
- 6.1887 1.0722 1.1351 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 7 1 0 0 0
- 4 16 1 0 0 0
- 5 6 1 0 0 0
- 5 17 1 0 0 0
- 5 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan034.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5124 0.0000 0.0000 C 0 0 0 0 0
- 2.0939 1.4181 0.0000 C 0 0 0 0 0
- 3.5411 1.4650 0.5638 C 0 0 0 0 0
- 4.0245 2.9170 0.5955 C 0 0 0 0 0
- 3.5535 0.9277 1.9965 C 0 0 0 0 0
- 4.5038 0.6377 -0.2850 C 0 0 0 0 0
- 2.0059 2.0194 -1.3963 C 0 0 0 0 0
- -0.3950 -1.0240 -0.0006 H 0 0 0 0 0
- -0.4075 0.5077 0.8847 H 0 0 0 0 0
- -0.4088 0.5085 -0.8839 H 0 0 0 0 0
- 1.8830 -0.5518 0.8934 H 0 0 0 0 0
- 1.8898 -0.5680 -0.8742 H 0 0 0 0 0
- 1.4723 2.0476 0.6867 H 0 0 0 0 0
- 5.0747 2.9828 0.9072 H 0 0 0 0 0
- 3.9362 3.3840 -0.3991 H 0 0 0 0 0
- 3.4323 3.5230 1.2941 H 0 0 0 0 0
- 4.5706 0.9119 2.4086 H 0 0 0 0 0
- 2.9343 1.5425 2.6631 H 0 0 0 0 0
- 3.1579 -0.1004 2.0360 H 0 0 0 0 0
- 5.5227 0.6692 0.1242 H 0 0 0 0 0
- 4.1985 -0.4165 -0.3268 H 0 0 0 0 0
- 4.5525 1.0103 -1.3170 H 0 0 0 0 0
- 2.5333 2.9863 -1.4446 H 0 0 0 0 0
- 2.4549 1.3667 -2.1578 H 0 0 0 0 0
- 0.9621 2.1921 -1.6893 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 8 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 7 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan035.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5212 0.0000 0.0000 C 0 0 0 0 0
- 2.0518 1.4388 0.0000 C 0 0 0 0 0
- 3.3844 1.6526 -0.7438 C 0 0 0 0 0
- 3.6701 3.1557 -0.7956 C 0 0 0 0 0
- 4.5343 0.9659 -0.0113 C 0 0 0 0 0
- 3.2933 1.1203 -2.1720 C 0 0 0 0 0
- 2.0344 -0.7924 1.1913 C 0 0 0 0 0
- -0.3977 -1.0232 0.0205 H 0 0 0 0 0
- -0.4038 0.5266 0.8751 H 0 0 0 0 0
- -0.4044 0.4906 -0.8952 H 0 0 0 0 0
- 1.8745 -0.5059 -0.9390 H 0 0 0 0 0
- 1.2936 2.1026 -0.4661 H 0 0 0 0 0
- 2.1599 1.7987 1.0434 H 0 0 0 0 0
- 4.6260 3.3596 -1.2961 H 0 0 0 0 0
- 2.8889 3.6975 -1.3456 H 0 0 0 0 0
- 3.7255 3.5890 0.2119 H 0 0 0 0 0
- 5.4767 1.0582 -0.5667 H 0 0 0 0 0
- 4.6912 1.4045 0.9834 H 0 0 0 0 0
- 4.3332 -0.1079 0.1349 H 0 0 0 0 0
- 4.2500 1.2176 -2.7007 H 0 0 0 0 0
- 3.0114 0.0546 -2.1760 H 0 0 0 0 0
- 2.5350 1.6618 -2.7527 H 0 0 0 0 0
- 3.1356 -0.8419 1.1851 H 0 0 0 0 0
- 1.7281 -0.3417 2.1446 H 0 0 0 0 0
- 1.6563 -1.8228 1.1781 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 8 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 13 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 7 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan036.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5121 0.0000 0.0000 C 0 0 0 0 0
- 2.1437 1.4081 0.0000 C 0 0 0 0 0
- 3.6895 1.2482 0.0765 C 0 0 0 0 0
- 4.4144 2.5842 0.0072 C 0 0 0 0 0
- 4.1066 0.5111 1.3412 C 0 0 0 0 0
- 1.7713 2.1275 -1.2967 C 0 0 0 0 0
- 1.6387 2.2149 1.1958 C 0 0 0 0 0
- -0.3967 -1.0045 0.1915 H 0 0 0 0 0
- -0.3979 0.6737 0.7771 H 0 0 0 0 0
- -0.4097 0.3374 -0.9615 H 0 0 0 0 0
- 1.8926 -0.5551 0.8874 H 0 0 0 0 0
- 1.8824 -0.5652 -0.8793 H 0 0 0 0 0
- 3.9998 0.6400 -0.8095 H 0 0 0 0 0
- 5.4941 2.4425 -0.1269 H 0 0 0 0 0
- 4.0452 3.1919 -0.8350 H 0 0 0 0 0
- 4.2707 3.1749 0.9223 H 0 0 0 0 0
- 5.1940 0.3882 1.3989 H 0 0 0 0 0
- 3.7719 1.0588 2.2383 H 0 0 0 0 0
- 3.6424 -0.4874 1.3854 H 0 0 0 0 0
- 2.3588 3.0525 -1.4188 H 0 0 0 0 0
- 1.9651 1.4991 -2.1761 H 0 0 0 0 0
- 0.7086 2.4023 -1.3112 H 0 0 0 0 0
- 1.8349 3.2876 1.0720 H 0 0 0 0 0
- 0.5530 2.0845 1.3331 H 0 0 0 0 0
- 2.1381 1.8908 2.1241 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 7 1 0 0 0
- 3 8 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 14 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan037.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5249 0.0000 0.0000 C 0 0 0 0 0
- 2.0898 1.4422 0.0000 C 0 0 0 0 0
- 3.6398 1.4542 -0.0256 C 0 0 0 0 0
- 4.2419 2.6330 -0.7787 C 0 0 0 0 0
- 4.2095 1.4641 1.3889 C 0 0 0 0 0
- 1.5001 2.2084 -1.1782 C 0 0 0 0 0
- 1.9862 -0.8224 1.1937 C 0 0 0 0 0
- -0.3957 -1.0203 -0.0832 H 0 0 0 0 0
- -0.4039 0.4371 0.9233 H 0 0 0 0 0
- -0.4073 0.5843 -0.8402 H 0 0 0 0 0
- 1.8788 -0.5003 -0.9354 H 0 0 0 0 0
- 1.7483 1.9428 0.9400 H 0 0 0 0 0
- 3.9836 0.5220 -0.5398 H 0 0 0 0 0
- 5.3391 2.6147 -0.7174 H 0 0 0 0 0
- 3.9840 2.6207 -1.8462 H 0 0 0 0 0
- 3.9110 3.5957 -0.3658 H 0 0 0 0 0
- 5.3075 1.4840 1.3771 H 0 0 0 0 0
- 3.8722 2.3410 1.9576 H 0 0 0 0 0
- 3.9081 0.5659 1.9503 H 0 0 0 0 0
- 1.7321 3.2803 -1.1262 H 0 0 0 0 0
- 1.8726 1.8296 -2.1399 H 0 0 0 0 0
- 0.4015 2.1192 -1.2034 H 0 0 0 0 0
- 3.0835 -0.8440 1.2851 H 0 0 0 0 0
- 1.5931 -0.4185 2.1374 H 0 0 0 0 0
- 1.6414 -1.8615 1.1127 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 8 1 0 0 0
- 2 12 1 0 0 0
- 3 4 1 0 0 0
- 3 7 1 0 0 0
- 3 13 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 14 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan038.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5121 0.0000 0.0000 C 0 0 0 0 0
- 2.1071 1.4160 0.0000 C 0 0 0 0 0
- 3.4931 1.4261 0.6830 C 0 0 0 0 0
- 4.0955 2.8242 0.7075 C 0 0 0 0 0
- 3.4174 0.9094 2.1132 C 0 0 0 0 0
- 2.2076 1.9500 -1.4365 C 0 0 0 0 0
- 0.9191 2.5759 -1.9206 C 0 0 0 0 0
- -0.3970 -1.0225 -0.0313 H 0 0 0 0 0
- -0.4066 0.4833 0.8983 H 0 0 0 0 0
- -0.4057 0.5394 -0.8718 H 0 0 0 0 0
- 1.8705 -0.5615 0.8918 H 0 0 0 0 0
- 1.8917 -0.5689 -0.8728 H 0 0 0 0 0
- 1.4374 2.0900 0.5904 H 0 0 0 0 0
- 4.1672 0.7559 0.0955 H 0 0 0 0 0
- 5.1007 2.8156 1.1479 H 0 0 0 0 0
- 4.1812 3.2432 -0.3079 H 0 0 0 0 0
- 3.4815 3.5187 1.2965 H 0 0 0 0 0
- 4.4124 0.8722 2.5748 H 0 0 0 0 0
- 2.7843 1.5500 2.7416 H 0 0 0 0 0
- 2.9952 -0.1074 2.1521 H 0 0 0 0 0
- 3.0211 2.7070 -1.5027 H 0 0 0 0 0
- 2.5143 1.1338 -2.1215 H 0 0 0 0 0
- 1.0092 2.9169 -2.9597 H 0 0 0 0 0
- 0.0799 1.8621 -1.8780 H 0 0 0 0 0
- 0.6360 3.4453 -1.3124 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 7 1 0 0 0
- 3 14 1 0 0 0
- 4 5 1 0 0 0
- 4 6 1 0 0 0
- 4 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 5 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan039.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5132 0.0000 0.0000 C 0 0 0 0 0
- 2.1273 1.4230 0.0000 C 0 0 0 0 0
- 3.6591 1.2390 -0.0227 C 0 0 0 0 0
- 4.4703 2.4889 -0.2775 C 0 0 0 0 0
- 1.6493 2.1596 -1.2495 C 0 0 0 0 0
- 1.6634 2.1377 1.2856 C 0 0 0 0 0
- 1.9087 3.6284 1.3299 C 0 0 0 0 0
- -0.4051 -1.0179 -0.0121 H 0 0 0 0 0
- -0.3947 0.5165 0.8906 H 0 0 0 0 0
- -0.3913 0.5375 -0.8797 H 0 0 0 0 0
- 1.8873 -0.5585 0.8812 H 0 0 0 0 0
- 1.8797 -0.5544 -0.8874 H 0 0 0 0 0
- 3.9783 0.7859 0.9383 H 0 0 0 0 0
- 3.9153 0.4916 -0.8025 H 0 0 0 0 0
- 5.5444 2.2627 -0.2793 H 0 0 0 0 0
- 4.2299 2.9439 -1.2480 H 0 0 0 0 0
- 4.2974 3.2565 0.4940 H 0 0 0 0 0
- 1.7896 3.2485 -1.1545 H 0 0 0 0 0
- 2.1876 1.8246 -2.1454 H 0 0 0 0 0
- 0.5749 1.9797 -1.4233 H 0 0 0 0 0
- 0.5723 1.9461 1.4115 H 0 0 0 0 0
- 2.1475 1.6557 2.1590 H 0 0 0 0 0
- 1.3833 4.0921 2.1735 H 0 0 0 0 0
- 2.9799 3.8644 1.4358 H 0 0 0 0 0
- 1.5638 4.1182 0.4043 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 12 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 6 1 0 0 0
- 3 7 1 0 0 0
- 4 5 1 0 0 0
- 4 14 1 0 0 0
- 4 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 5 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan040.hin
- OpenBabel0803D
- 26 25 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5308 0.0000 0.0000 C 0 0 0 0 0
- 2.0800 1.4674 0.0000 C 0 0 0 0 0
- 3.6106 1.4675 -0.0208 C 0 0 0 0 0
- 1.5801 2.2277 -1.2310 C 0 0 0 0 0
- 1.6131 2.2140 1.2521 C 0 0 0 0 0
- 2.0137 -0.7541 1.2417 C 0 0 0 0 0
- 2.0144 -0.7534 -1.2416 C 0 0 0 0 0
- -0.3980 -1.0009 0.2118 H 0 0 0 0 0
- -0.3939 0.6888 0.7656 H 0 0 0 0 0
- -0.4060 0.3166 -0.9700 H 0 0 0 0 0
- 4.0119 2.4662 0.1954 H 0 0 0 0 0
- 4.0151 0.7713 0.7326 H 0 0 0 0 0
- 4.0030 1.1600 -0.9993 H 0 0 0 0 0
- 2.1171 3.1767 -1.3580 H 0 0 0 0 0
- 1.7257 1.6323 -2.1475 H 0 0 0 0 0
- 0.5100 2.4628 -1.1561 H 0 0 0 0 0
- 1.8110 3.2907 1.1708 H 0 0 0 0 0
- 0.5298 2.0808 1.4089 H 0 0 0 0 0
- 2.1245 1.8525 2.1542 H 0 0 0 0 0
- 3.0975 -0.6162 1.3899 H 0 0 0 0 0
- 1.5083 -0.4033 2.1514 H 0 0 0 0 0
- 1.8214 -1.8313 1.1533 H 0 0 0 0 0
- 3.0849 -0.9908 -1.1808 H 0 0 0 0 0
- 1.4742 -1.7005 -1.3683 H 0 0 0 0 0
- 1.8592 -0.1521 -2.1527 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 9 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 2 3 1 0 0 0
- 2 7 1 0 0 0
- 2 8 1 0 0 0
- 3 4 1 0 0 0
- 3 5 1 0 0 0
- 3 6 1 0 0 0
- 4 12 1 0 0 0
- 4 13 1 0 0 0
- 4 14 1 0 0 0
- 5 15 1 0 0 0
- 5 16 1 0 0 0
- 5 17 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- M END
- $$$$
- dan041.hin
- OpenBabel0803D
- 29 28 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0689 1.4147 0.0000 C 0 0 0 0 0
- 3.5889 1.4123 0.0034 C 0 0 0 0 0
- 4.1441 2.8275 0.0002 C 0 0 0 0 0
- 5.6642 2.8250 0.0060 C 0 0 0 0 0
- 6.2194 4.2400 0.0006 C 0 0 0 0 0
- 7.7397 4.2396 0.0098 C 0 0 0 0 0
- 8.2939 5.6464 0.0017 C 0 0 0 0 0
- -0.3985 -1.0225 -0.0001 H 0 0 0 0 0
- -0.4053 0.5101 0.8841 H 0 0 0 0 0
- -0.4050 0.5102 -0.8841 H 0 0 0 0 0
- 1.8904 -0.5539 0.8822 H 0 0 0 0 0
- 1.8903 -0.5537 -0.8823 H 0 0 0 0 0
- 1.6926 1.9680 -0.8840 H 0 0 0 0 0
- 1.6886 1.9699 0.8811 H 0 0 0 0 0
- 3.9646 0.8601 0.8884 H 0 0 0 0 0
- 3.9684 0.8550 -0.8768 H 0 0 0 0 0
- 3.7699 3.3786 -0.8861 H 0 0 0 0 0
- 3.7630 3.3856 0.8792 H 0 0 0 0 0
- 6.0385 2.2748 0.8928 H 0 0 0 0 0
- 6.0451 2.2657 -0.8724 H 0 0 0 0 0
- 5.8477 4.7895 -0.8877 H 0 0 0 0 0
- 5.8369 4.8008 0.8772 H 0 0 0 0 0
- 8.1108 3.6916 0.8987 H 0 0 0 0 0
- 8.1213 3.6775 -0.8657 H 0 0 0 0 0
- 9.3912 5.6426 0.0088 H 0 0 0 0 0
- 7.9734 6.2027 -0.8893 H 0 0 0 0 0
- 7.9618 6.2176 0.8788 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 13 1 0 0 0
- 2 14 1 0 0 0
- 3 4 1 0 0 0
- 3 15 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 17 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 19 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 21 1 0 0 0
- 6 22 1 0 0 0
- 7 8 1 0 0 0
- 7 23 1 0 0 0
- 7 24 1 0 0 0
- 8 9 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- M END
- $$$$
- dan042.hin
- OpenBabel0803D
- 29 28 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0693 1.4145 0.0000 C 0 0 0 0 0
- 3.5893 1.4116 -0.0051 C 0 0 0 0 0
- 4.1443 2.8254 -0.0067 C 0 0 0 0 0
- 5.6652 2.8291 0.0011 C 0 0 0 0 0
- 6.2218 4.2414 -0.1881 C 0 0 0 0 0
- 7.7273 4.2493 0.0147 C 0 0 0 0 0
- 5.8676 4.7749 -1.5672 C 0 0 0 0 0
- -0.3985 -1.0225 0.0038 H 0 0 0 0 0
- -0.4053 0.5135 0.8821 H 0 0 0 0 0
- -0.4050 0.5067 -0.8861 H 0 0 0 0 0
- 1.8906 -0.5539 0.8821 H 0 0 0 0 0
- 1.8900 -0.5538 -0.8824 H 0 0 0 0 0
- 1.6889 1.9701 -0.8808 H 0 0 0 0 0
- 1.6936 1.9680 0.8842 H 0 0 0 0 0
- 3.9708 0.8577 0.8764 H 0 0 0 0 0
- 3.9631 0.8561 -0.8889 H 0 0 0 0 0
- 3.7858 3.3864 -0.9007 H 0 0 0 0 0
- 3.7589 3.3868 0.8680 H 0 0 0 0 0
- 6.0396 2.4016 0.9525 H 0 0 0 0 0
- 6.0528 2.1652 -0.7982 H 0 0 0 0 0
- 5.7565 4.9073 0.5799 H 0 0 0 0 0
- 8.1405 5.2570 -0.1221 H 0 0 0 0 0
- 7.9989 3.9147 1.0244 H 0 0 0 0 0
- 8.2353 3.5863 -0.6987 H 0 0 0 0 0
- 6.1117 5.8397 -1.6635 H 0 0 0 0 0
- 6.4047 4.2386 -2.3607 H 0 0 0 0 0
- 4.7884 4.6517 -1.7590 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 13 1 0 0 0
- 2 14 1 0 0 0
- 3 4 1 0 0 0
- 3 15 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 17 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 19 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 21 1 0 0 0
- 6 22 1 0 0 0
- 7 8 1 0 0 0
- 7 9 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- M END
- $$$$
- dan043.hin
- OpenBabel0803D
- 29 28 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5119 0.0000 0.0000 C 0 0 0 0 0
- 2.0692 1.4146 0.0000 C 0 0 0 0 0
- 3.5880 1.4112 0.0051 C 0 0 0 0 0
- 4.1501 2.8245 -0.0129 C 0 0 0 0 0
- 5.6702 2.8259 0.1717 C 0 0 0 0 0
- 6.2247 4.2332 -0.0569 C 0 0 0 0 0
- 7.7276 4.2437 -0.2264 C 0 0 0 0 0
- 6.0293 2.3067 1.5557 C 0 0 0 0 0
- -0.3986 -1.0225 -0.0001 H 0 0 0 0 0
- -0.4053 0.5102 0.8840 H 0 0 0 0 0
- -0.4049 0.5101 -0.8842 H 0 0 0 0 0
- 1.8907 -0.5536 0.8822 H 0 0 0 0 0
- 1.8901 -0.5539 -0.8823 H 0 0 0 0 0
- 1.6955 1.9680 -0.8849 H 0 0 0 0 0
- 1.6871 1.9702 0.8802 H 0 0 0 0 0
- 3.9752 0.8773 0.9036 H 0 0 0 0 0
- 3.9703 0.8404 -0.8648 H 0 0 0 0 0
- 3.8826 3.3204 -0.9676 H 0 0 0 0 0
- 3.6774 3.4341 0.7837 H 0 0 0 0 0
- 6.1162 2.1417 -0.5923 H 0 0 0 0 0
- 5.7533 4.6740 -0.9587 H 0 0 0 0 0
- 5.9319 4.8934 0.7839 H 0 0 0 0 0
- 8.0980 5.2604 -0.4099 H 0 0 0 0 0
- 8.2428 3.8645 0.6667 H 0 0 0 0 0
- 8.0449 3.6210 -1.0737 H 0 0 0 0 0
- 7.1078 2.1328 1.6587 H 0 0 0 0 0
- 5.7301 3.0090 2.3452 H 0 0 0 0 0
- 5.5116 1.3523 1.7512 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 13 1 0 0 0
- 2 14 1 0 0 0
- 3 4 1 0 0 0
- 3 15 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 17 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 19 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 9 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- M END
- $$$$
- dan044.hin
- OpenBabel0803D
- 29 28 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5122 0.0000 0.0000 C 0 0 0 0 0
- 2.0691 1.4150 0.0000 C 0 0 0 0 0
- 3.5896 1.4102 -0.0101 C 0 0 0 0 0
- 4.1752 2.8231 -0.0136 C 0 0 0 0 0
- 5.6703 2.7695 0.3133 C 0 0 0 0 0
- 6.2500 4.1617 0.5142 C 0 0 0 0 0
- 7.7537 4.1252 0.6578 C 0 0 0 0 0
- 3.9572 3.5102 -1.3532 C 0 0 0 0 0
- -0.3987 -1.0225 0.0097 H 0 0 0 0 0
- -0.4053 0.5187 0.8791 H 0 0 0 0 0
- -0.4051 0.5017 -0.8890 H 0 0 0 0 0
- 1.8908 -0.5544 0.8818 H 0 0 0 0 0
- 1.8900 -0.5535 -0.8827 H 0 0 0 0 0
- 1.6835 1.9709 -0.8792 H 0 0 0 0 0
- 1.6965 1.9673 0.8863 H 0 0 0 0 0
- 3.9592 0.8563 0.8772 H 0 0 0 0 0
- 3.9623 0.8455 -0.8888 H 0 0 0 0 0
- 3.6649 3.4217 0.7814 H 0 0 0 0 0
- 5.8388 2.1607 1.2243 H 0 0 0 0 0
- 6.2112 2.2455 -0.5006 H 0 0 0 0 0
- 5.9545 4.8043 -0.3466 H 0 0 0 0 0
- 5.7938 4.6350 1.4060 H 0 0 0 0 0
- 8.1631 5.1310 0.8171 H 0 0 0 0 0
- 8.0632 3.5054 1.5099 H 0 0 0 0 0
- 8.2371 3.7123 -0.2377 H 0 0 0 0 0
- 4.5035 4.4681 -1.3847 H 0 0 0 0 0
- 4.3210 2.8983 -2.1894 H 0 0 0 0 0
- 2.8954 3.7209 -1.5351 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 13 1 0 0 0
- 2 14 1 0 0 0
- 3 4 1 0 0 0
- 3 15 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 17 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 9 1 0 0 0
- 5 19 1 0 0 0
- 6 7 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- M END
- $$$$
- dan045.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5119 0.0000 0.0000 C 0 0 0 0 0
- 2.0693 1.4145 0.0000 C 0 0 0 0 0
- 3.5893 1.4116 -0.0031 C 0 0 0 0 0
- 4.1430 2.8244 0.0062 C 0 0 0 0 0
- 5.6643 2.8333 0.0005 C 0 0 0 0 0
- 6.2387 4.2613 0.0113 C 0 0 0 0 0
- 7.7644 4.1872 0.0048 C 0 0 0 0 0
- 5.7671 5.0145 -1.2313 C 0 0 0 0 0
- 5.7767 4.9918 1.2710 C 0 0 0 0 0
- -0.3985 -1.0225 0.0044 H 0 0 0 0 0
- -0.4052 0.5140 0.8818 H 0 0 0 0 0
- -0.4050 0.5063 -0.8864 H 0 0 0 0 0
- 1.8904 -0.5539 0.8822 H 0 0 0 0 0
- 1.8902 -0.5537 -0.8823 H 0 0 0 0 0
- 1.6897 1.9698 -0.8813 H 0 0 0 0 0
- 1.6931 1.9683 0.8837 H 0 0 0 0 0
- 3.9693 0.8506 0.8746 H 0 0 0 0 0
- 3.9653 0.8640 -0.8909 H 0 0 0 0 0
- 3.7721 3.4027 -0.8708 H 0 0 0 0 0
- 3.7786 3.3887 0.8951 H 0 0 0 0 0
- 6.0485 2.2758 0.8784 H 0 0 0 0 0
- 6.0417 2.2921 -0.8904 H 0 0 0 0 0
- 8.2083 5.1913 0.0143 H 0 0 0 0 0
- 8.1452 3.6486 0.8828 H 0 0 0 0 0
- 8.1385 3.6683 -0.8878 H 0 0 0 0 0
- 6.0311 6.0785 -1.1863 H 0 0 0 0 0
- 6.2147 4.5992 -2.1439 H 0 0 0 0 0
- 4.6725 4.9368 -1.3398 H 0 0 0 0 0
- 6.0419 6.0561 1.2441 H 0 0 0 0 0
- 4.6827 4.9136 1.3855 H 0 0 0 0 0
- 6.2301 4.5588 2.1724 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 4 19 1 0 0 0
- 5 6 1 0 0 0
- 5 20 1 0 0 0
- 5 21 1 0 0 0
- 6 7 1 0 0 0
- 6 22 1 0 0 0
- 6 23 1 0 0 0
- 7 8 1 0 0 0
- 7 9 1 0 0 0
- 7 10 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan046.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5119 0.0000 0.0000 C 0 0 0 0 0
- 2.0693 1.4145 0.0000 C 0 0 0 0 0
- 3.5882 1.4108 0.0072 C 0 0 0 0 0
- 4.1501 2.8231 -0.0117 C 0 0 0 0 0
- 5.6743 2.8241 0.1524 C 0 0 0 0 0
- 6.2454 4.2241 -0.1429 C 0 0 0 0 0
- 7.7437 4.2885 0.1105 C 0 0 0 0 0
- 5.9641 4.6247 -1.5847 C 0 0 0 0 0
- 6.0300 2.3492 1.5538 C 0 0 0 0 0
- -0.3986 -1.0225 0.0014 H 0 0 0 0 0
- -0.4053 0.5115 0.8833 H 0 0 0 0 0
- -0.4049 0.5089 -0.8849 H 0 0 0 0 0
- 1.8906 -0.5535 0.8823 H 0 0 0 0 0
- 1.8901 -0.5541 -0.8821 H 0 0 0 0 0
- 1.6971 1.9674 -0.8859 H 0 0 0 0 0
- 1.6862 1.9708 0.8792 H 0 0 0 0 0
- 3.9740 0.8808 0.9086 H 0 0 0 0 0
- 3.9715 0.8377 -0.8607 H 0 0 0 0 0
- 3.8779 3.3324 -0.9635 H 0 0 0 0 0
- 3.6872 3.4295 0.7931 H 0 0 0 0 0
- 6.1120 2.1087 -0.5877 H 0 0 0 0 0
- 5.7387 4.9539 0.5359 H 0 0 0 0 0
- 8.1554 5.2569 -0.2031 H 0 0 0 0 0
- 7.9825 4.1624 1.1751 H 0 0 0 0 0
- 8.2816 3.5069 -0.4428 H 0 0 0 0 0
- 6.2418 5.6696 -1.7715 H 0 0 0 0 0
- 6.5244 4.0014 -2.2943 H 0 0 0 0 0
- 4.8939 4.5129 -1.8240 H 0 0 0 0 0
- 7.0953 2.1020 1.6457 H 0 0 0 0 0
- 5.7977 3.1078 2.3129 H 0 0 0 0 0
- 5.4538 1.4419 1.8037 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 4 19 1 0 0 0
- 5 6 1 0 0 0
- 5 20 1 0 0 0
- 5 21 1 0 0 0
- 6 7 1 0 0 0
- 6 10 1 0 0 0
- 6 22 1 0 0 0
- 7 8 1 0 0 0
- 7 9 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan047.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0684 1.4136 0.0000 C 0 0 0 0 0
- 3.5894 1.4171 0.0134 C 0 0 0 0 0
- 4.1484 2.8309 -0.1759 C 0 0 0 0 0
- 5.6638 2.8346 0.0500 C 0 0 0 0 0
- 6.2070 4.1853 0.5277 C 0 0 0 0 0
- 7.5230 3.9877 1.2657 C 0 0 0 0 0
- 6.4076 5.1533 -0.6269 C 0 0 0 0 0
- 3.7850 3.3479 -1.5593 C 0 0 0 0 0
- -0.3986 -1.0224 0.0000 H 0 0 0 0 0
- -0.4055 0.5103 0.8838 H 0 0 0 0 0
- -0.4045 0.5102 -0.8843 H 0 0 0 0 0
- 1.8914 -0.5526 0.8825 H 0 0 0 0 0
- 1.8896 -0.5546 -0.8821 H 0 0 0 0 0
- 1.7104 1.9741 -0.8943 H 0 0 0 0 0
- 1.6797 1.9743 0.8737 H 0 0 0 0 0
- 3.9550 0.9877 0.9680 H 0 0 0 0 0
- 3.9804 0.7520 -0.7829 H 0 0 0 0 0
- 3.6717 3.4956 0.5879 H 0 0 0 0 0
- 5.9154 2.0645 0.8093 H 0 0 0 0 0
- 6.1900 2.5190 -0.8733 H 0 0 0 0 0
- 5.4703 4.6332 1.2402 H 0 0 0 0 0
- 7.9404 4.9471 1.5985 H 0 0 0 0 0
- 7.3973 3.3581 2.1564 H 0 0 0 0 0
- 8.2754 3.5065 0.6264 H 0 0 0 0 0
- 6.7459 6.1349 -0.2710 H 0 0 0 0 0
- 7.1579 4.7847 -1.3394 H 0 0 0 0 0
- 5.4704 5.3056 -1.1867 H 0 0 0 0 0
- 4.0715 4.4041 -1.6816 H 0 0 0 0 0
- 4.2846 2.7771 -2.3535 H 0 0 0 0 0
- 2.6986 3.2619 -1.7271 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 4 19 1 0 0 0
- 5 6 1 0 0 0
- 5 10 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 21 1 0 0 0
- 6 22 1 0 0 0
- 7 8 1 0 0 0
- 7 9 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan048.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5121 0.0000 0.0000 C 0 0 0 0 0
- 2.0668 1.4161 0.0000 C 0 0 0 0 0
- 3.5959 1.4430 -0.0082 C 0 0 0 0 0
- 4.0924 2.8494 -0.3569 C 0 0 0 0 0
- 5.5970 2.8670 -0.5820 C 0 0 0 0 0
- 6.1523 4.2812 -0.7498 C 0 0 0 0 0
- 7.6656 4.2674 -0.5987 C 0 0 0 0 0
- 5.7700 4.8689 -2.0987 C 0 0 0 0 0
- 4.1650 1.0044 1.3327 C 0 0 0 0 0
- -0.3982 -1.0226 0.0027 H 0 0 0 0 0
- -0.4054 0.5124 0.8827 H 0 0 0 0 0
- -0.4055 0.5075 -0.8855 H 0 0 0 0 0
- 1.8899 -0.5552 0.8824 H 0 0 0 0 0
- 1.8901 -0.5537 -0.8825 H 0 0 0 0 0
- 1.6796 1.9583 -0.8871 H 0 0 0 0 0
- 1.6836 1.9736 0.8787 H 0 0 0 0 0
- 3.9592 0.7385 -0.7972 H 0 0 0 0 0
- 3.5717 3.2204 -1.2633 H 0 0 0 0 0
- 3.8172 3.5529 0.4550 H 0 0 0 0 0
- 6.0888 2.3650 0.2837 H 0 0 0 0 0
- 5.8569 2.2522 -1.4671 H 0 0 0 0 0
- 5.7242 4.9298 0.0539 H 0 0 0 0 0
- 8.0871 5.2740 -0.7190 H 0 0 0 0 0
- 7.9688 3.8998 0.3904 H 0 0 0 0 0
- 8.1400 3.6209 -1.3493 H 0 0 0 0 0
- 6.1541 5.8912 -2.2106 H 0 0 0 0 0
- 6.1738 4.2735 -2.9288 H 0 0 0 0 0
- 4.6797 4.9105 -2.2247 H 0 0 0 0 0
- 5.2573 1.1578 1.3525 H 0 0 0 0 0
- 3.7384 1.5801 2.1649 H 0 0 0 0 0
- 3.9697 -0.0573 1.5306 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 10 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 19 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 21 1 0 0 0
- 6 22 1 0 0 0
- 7 8 1 0 0 0
- 7 9 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan049.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5124 0.0000 0.0000 C 0 0 0 0 0
- 2.0995 1.4125 0.0000 C 0 0 0 0 0
- 3.5915 1.3601 0.3414 C 0 0 0 0 0
- 4.1624 2.7532 0.5479 C 0 0 0 0 0
- 5.6740 2.7308 0.7030 C 0 0 0 0 0
- 6.2535 4.1466 0.7123 C 0 0 0 0 0
- 7.7326 4.1118 1.0566 C 0 0 0 0 0
- 6.0355 4.8215 -0.6328 C 0 0 0 0 0
- 1.8948 2.0984 -1.3424 C 0 0 0 0 0
- -0.3955 -1.0235 0.0267 H 0 0 0 0 0
- -0.4063 0.5317 0.8709 H 0 0 0 0 0
- -0.4092 0.4847 -0.8969 H 0 0 0 0 0
- 1.8770 -0.5514 0.8904 H 0 0 0 0 0
- 1.8925 -0.5646 -0.8749 H 0 0 0 0 0
- 1.5802 2.0115 0.7890 H 0 0 0 0 0
- 3.7528 0.7517 1.2538 H 0 0 0 0 0
- 4.1393 0.8365 -0.4683 H 0 0 0 0 0
- 3.8860 3.4050 -0.3206 H 0 0 0 0 0
- 3.6951 3.2292 1.4327 H 0 0 0 0 0
- 5.9504 2.2039 1.6378 H 0 0 0 0 0
- 6.1353 2.1454 -0.1183 H 0 0 0 0 0
- 5.7202 4.7385 1.4965 H 0 0 0 0 0
- 8.1626 5.1218 1.0612 H 0 0 0 0 0
- 7.9043 3.6746 2.0488 H 0 0 0 0 0
- 8.3030 3.5153 0.3317 H 0 0 0 0 0
- 6.2884 5.8880 -0.5954 H 0 0 0 0 0
- 6.6470 4.3632 -1.4213 H 0 0 0 0 0
- 4.9799 4.7301 -0.9402 H 0 0 0 0 0
- 2.4467 3.0534 -1.3716 H 0 0 0 0 0
- 2.2613 1.4833 -2.1751 H 0 0 0 0 0
- 0.8360 2.3149 -1.5321 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 10 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 17 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 19 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 21 1 0 0 0
- 6 22 1 0 0 0
- 7 8 1 0 0 0
- 7 9 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan050.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5119 0.0000 0.0000 C 0 0 0 0 0
- 2.0691 1.4146 0.0000 C 0 0 0 0 0
- 3.5867 1.4104 -0.0120 C 0 0 0 0 0
- 4.1527 2.8226 -0.0069 C 0 0 0 0 0
- 5.6963 2.8452 -0.0200 C 0 0 0 0 0
- 6.1427 4.3195 -0.0162 C 0 0 0 0 0
- 7.6413 4.5224 -0.0301 C 0 0 0 0 0
- 6.2191 2.1286 1.2241 C 0 0 0 0 0
- 6.1977 2.1419 -1.2803 C 0 0 0 0 0
- -0.3986 -1.0225 0.0017 H 0 0 0 0 0
- -0.4051 0.5117 0.8832 H 0 0 0 0 0
- -0.4050 0.5087 -0.8850 H 0 0 0 0 0
- 1.8909 -0.5539 0.8819 H 0 0 0 0 0
- 1.8901 -0.5534 -0.8825 H 0 0 0 0 0
- 1.6847 1.9720 -0.8780 H 0 0 0 0 0
- 1.6984 1.9665 0.8873 H 0 0 0 0 0
- 3.9743 0.8640 -0.9021 H 0 0 0 0 0
- 3.9881 0.8522 0.8646 H 0 0 0 0 0
- 3.7692 3.3811 -0.8847 H 0 0 0 0 0
- 3.7842 3.3694 0.8846 H 0 0 0 0 0
- 5.6968 4.8332 -0.8925 H 0 0 0 0 0
- 5.7143 4.8229 0.8746 H 0 0 0 0 0
- 7.8912 5.5913 -0.0131 H 0 0 0 0 0
- 8.1261 4.0595 0.8402 H 0 0 0 0 0
- 8.1047 4.0929 -0.9287 H 0 0 0 0 0
- 7.2985 1.9371 1.1659 H 0 0 0 0 0
- 6.0349 2.7182 2.1319 H 0 0 0 0 0
- 5.7121 1.1578 1.3550 H 0 0 0 0 0
- 7.2791 1.9563 -1.2452 H 0 0 0 0 0
- 5.6934 1.1695 -1.4092 H 0 0 0 0 0
- 5.9920 2.7380 -2.1792 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 4 19 1 0 0 0
- 5 6 1 0 0 0
- 5 20 1 0 0 0
- 5 21 1 0 0 0
- 6 7 1 0 0 0
- 6 9 1 0 0 0
- 6 10 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan051.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0681 1.4137 0.0000 C 0 0 0 0 0
- 3.5884 1.4181 0.0205 C 0 0 0 0 0
- 4.1411 2.8336 -0.1743 C 0 0 0 0 0
- 5.6555 2.8875 0.1101 C 0 0 0 0 0
- 6.1998 4.3051 -0.0988 C 0 0 0 0 0
- 7.6975 4.3232 -0.3049 C 0 0 0 0 0
- 5.9556 2.4212 1.5278 C 0 0 0 0 0
- 3.8262 3.2975 -1.5897 C 0 0 0 0 0
- -0.3987 -1.0224 -0.0011 H 0 0 0 0 0
- -0.4055 0.5094 0.8844 H 0 0 0 0 0
- -0.4044 0.5111 -0.8838 H 0 0 0 0 0
- 1.8915 -0.5523 0.8826 H 0 0 0 0 0
- 1.8899 -0.5547 -0.8820 H 0 0 0 0 0
- 1.7170 1.9722 -0.8984 H 0 0 0 0 0
- 1.6745 1.9762 0.8701 H 0 0 0 0 0
- 3.9845 0.7494 -0.7706 H 0 0 0 0 0
- 3.9624 0.9953 0.9798 H 0 0 0 0 0
- 3.6319 3.5176 0.5493 H 0 0 0 0 0
- 6.1634 2.1985 -0.6097 H 0 0 0 0 0
- 5.6988 4.7682 -0.9790 H 0 0 0 0 0
- 5.9256 4.9449 0.7638 H 0 0 0 0 0
- 8.0645 5.3473 -0.4502 H 0 0 0 0 0
- 8.2344 3.9027 0.5566 H 0 0 0 0 0
- 7.9930 3.7406 -1.1878 H 0 0 0 0 0
- 7.0364 2.3539 1.7073 H 0 0 0 0 0
- 5.5374 3.1055 2.2786 H 0 0 0 0 0
- 5.5211 1.4262 1.7177 H 0 0 0 0 0
- 4.1451 4.3392 -1.7490 H 0 0 0 0 0
- 4.3345 2.6806 -2.3428 H 0 0 0 0 0
- 2.7429 3.2272 -1.7802 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 4 19 1 0 0 0
- 5 6 1 0 0 0
- 5 10 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 9 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan052.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5121 0.0000 0.0000 C 0 0 0 0 0
- 2.0666 1.4162 0.0000 C 0 0 0 0 0
- 3.5941 1.4421 0.0104 C 0 0 0 0 0
- 4.1004 2.8426 0.3709 C 0 0 0 0 0
- 5.6047 2.8310 0.6615 C 0 0 0 0 0
- 6.1426 4.2592 0.7418 C 0 0 0 0 0
- 7.6527 4.3132 0.6760 C 0 0 0 0 0
- 5.8814 2.0564 1.9403 C 0 0 0 0 0
- 4.1700 1.0099 -1.3290 C 0 0 0 0 0
- -0.3982 -1.0226 0.0027 H 0 0 0 0 0
- -0.4058 0.5124 0.8825 H 0 0 0 0 0
- -0.4050 0.5075 -0.8857 H 0 0 0 0 0
- 1.8906 -0.5536 0.8824 H 0 0 0 0 0
- 1.8899 -0.5550 -0.8824 H 0 0 0 0 0
- 1.6853 1.9728 -0.8800 H 0 0 0 0 0
- 1.6781 1.9594 0.8859 H 0 0 0 0 0
- 3.9681 0.7394 0.8056 H 0 0 0 0 0
- 3.8757 3.5443 -0.4576 H 0 0 0 0 0
- 3.5537 3.2321 1.2532 H 0 0 0 0 0
- 6.1041 2.2996 -0.1953 H 0 0 0 0 0
- 5.7196 4.8609 -0.0881 H 0 0 0 0 0
- 5.7844 4.7433 1.6723 H 0 0 0 0 0
- 8.0137 5.3489 0.7156 H 0 0 0 0 0
- 8.1182 3.7726 1.5114 H 0 0 0 0 0
- 8.0344 3.8676 -0.2524 H 0 0 0 0 0
- 6.9545 1.8786 2.0850 H 0 0 0 0 0
- 5.5106 2.5864 2.8278 H 0 0 0 0 0
- 5.3764 1.0760 1.9064 H 0 0 0 0 0
- 3.9720 -0.0496 -1.5351 H 0 0 0 0 0
- 3.7526 1.5927 -2.1609 H 0 0 0 0 0
- 5.2632 1.1592 -1.3371 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 10 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 19 1 0 0 0
- 5 20 1 0 0 0
- 6 7 1 0 0 0
- 6 9 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan053.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0678 1.4144 0.0000 C 0 0 0 0 0
- 3.5885 1.4142 -0.0353 C 0 0 0 0 0
- 4.2118 2.8018 0.2166 C 0 0 0 0 0
- 5.7429 2.6495 0.1188 C 0 0 0 0 0
- 6.5027 3.9422 0.3770 C 0 0 0 0 0
- 7.9675 3.8026 0.0321 C 0 0 0 0 0
- 3.7343 3.7995 -0.8372 C 0 0 0 0 0
- 3.8126 3.2910 1.6077 C 0 0 0 0 0
- -0.3986 -1.0224 0.0070 H 0 0 0 0 0
- -0.4047 0.5163 0.8807 H 0 0 0 0 0
- -0.4054 0.5041 -0.8874 H 0 0 0 0 0
- 1.8895 -0.5554 0.8817 H 0 0 0 0 0
- 1.8910 -0.5521 -0.8829 H 0 0 0 0 0
- 1.6658 1.9771 -0.8668 H 0 0 0 0 0
- 1.7190 1.9689 0.9013 H 0 0 0 0 0
- 3.9360 1.0233 -1.0131 H 0 0 0 0 0
- 3.9756 0.7059 0.7261 H 0 0 0 0 0
- 6.0850 1.8711 0.8306 H 0 0 0 0 0
- 6.0002 2.2673 -0.8906 H 0 0 0 0 0
- 6.0392 4.7641 -0.2146 H 0 0 0 0 0
- 6.3912 4.2426 1.4381 H 0 0 0 0 0
- 8.5155 4.7299 0.2420 H 0 0 0 0 0
- 8.4442 3.0006 0.6113 H 0 0 0 0 0
- 8.1149 3.5682 -1.0307 H 0 0 0 0 0
- 4.3463 4.7169 -0.8080 H 0 0 0 0 0
- 3.8135 3.3827 -1.8497 H 0 0 0 0 0
- 2.6882 4.0910 -0.6767 H 0 0 0 0 0
- 4.0635 4.3496 1.7541 H 0 0 0 0 0
- 2.7257 3.1798 1.7605 H 0 0 0 0 0
- 4.3168 2.7159 2.3952 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 4 19 1 0 0 0
- 5 6 1 0 0 0
- 5 9 1 0 0 0
- 5 10 1 0 0 0
- 6 7 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 8 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan054.hin
- OpenBabel0803D
- 29 28 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0680 1.4140 0.0000 C 0 0 0 0 0
- 3.5884 1.4165 0.0131 C 0 0 0 0 0
- 4.1629 2.8344 -0.0904 C 0 0 0 0 0
- 5.6751 2.7849 0.1582 C 0 0 0 0 0
- 6.2328 4.0933 0.6718 C 0 0 0 0 0
- 3.8208 3.4372 -1.4578 C 0 0 0 0 0
- 3.8212 4.9487 -1.4593 C 0 0 0 0 0
- -0.3986 -1.0224 0.0003 H 0 0 0 0 0
- -0.4054 0.5106 0.8837 H 0 0 0 0 0
- -0.4047 0.5099 -0.8844 H 0 0 0 0 0
- 1.8909 -0.5529 0.8826 H 0 0 0 0 0
- 1.8902 -0.5543 -0.8820 H 0 0 0 0 0
- 1.7097 1.9707 -0.8961 H 0 0 0 0 0
- 1.6789 1.9753 0.8729 H 0 0 0 0 0
- 3.9772 0.7961 -0.8196 H 0 0 0 0 0
- 3.9513 0.9315 0.9422 H 0 0 0 0 0
- 3.6892 3.4613 0.7058 H 0 0 0 0 0
- 5.9043 1.9859 0.8932 H 0 0 0 0 0
- 6.2013 2.4876 -0.7711 H 0 0 0 0 0
- 7.3179 4.0306 0.8228 H 0 0 0 0 0
- 6.0439 4.9194 -0.0334 H 0 0 0 0 0
- 5.7830 4.3781 1.6323 H 0 0 0 0 0
- 4.5203 3.0547 -2.2274 H 0 0 0 0 0
- 2.8126 3.0739 -1.7648 H 0 0 0 0 0
- 3.5942 5.3444 -2.4573 H 0 0 0 0 0
- 3.0735 5.3561 -0.7658 H 0 0 0 0 0
- 4.8004 5.3549 -1.1567 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 13 1 0 0 0
- 2 14 1 0 0 0
- 3 4 1 0 0 0
- 3 15 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 17 1 0 0 0
- 4 18 1 0 0 0
- 5 6 1 0 0 0
- 5 8 1 0 0 0
- 5 19 1 0 0 0
- 6 7 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 7 24 1 0 0 0
- 8 9 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- M END
- $$$$
- dan055.hin
- OpenBabel0803D
- 29 28 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5119 0.0000 0.0000 C 0 0 0 0 0
- 2.0677 1.4154 0.0000 C 0 0 0 0 0
- 3.6000 1.4556 -0.0120 C 0 0 0 0 0
- 4.0727 2.7715 0.6177 C 0 0 0 0 0
- 5.5767 2.7919 0.8426 C 0 0 0 0 0
- 6.0423 4.1273 1.3750 C 0 0 0 0 0
- 4.1721 1.3195 -1.4279 C 0 0 0 0 0
- 4.2722 -0.1145 -1.8952 C 0 0 0 0 0
- -0.3979 -1.0227 0.0043 H 0 0 0 0 0
- -0.4059 0.5136 0.8818 H 0 0 0 0 0
- -0.4053 0.5060 -0.8864 H 0 0 0 0 0
- 1.8900 -0.5550 0.8816 H 0 0 0 0 0
- 1.8936 -0.5551 -0.8858 H 0 0 0 0 0
- 1.6653 1.9789 -0.8663 H 0 0 0 0 0
- 1.6869 1.9470 0.8971 H 0 0 0 0 0
- 3.9876 0.6126 0.6130 H 0 0 0 0 0
- 3.7743 3.6218 -0.0282 H 0 0 0 0 0
- 3.5528 2.9332 1.5839 H 0 0 0 0 0
- 5.8658 1.9815 1.5405 H 0 0 0 0 0
- 6.0897 2.5561 -0.1174 H 0 0 0 0 0
- 7.1268 4.1330 1.5423 H 0 0 0 0 0
- 5.8133 4.9441 0.6777 H 0 0 0 0 0
- 5.5609 4.3713 2.3314 H 0 0 0 0 0
- 3.5654 1.9115 -2.1416 H 0 0 0 0 0
- 5.1876 1.7790 -1.4477 H 0 0 0 0 0
- 4.6716 -0.1721 -2.9156 H 0 0 0 0 0
- 4.9332 -0.7077 -1.2491 H 0 0 0 0 0
- 3.2882 -0.6114 -1.8970 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 13 1 0 0 0
- 2 14 1 0 0 0
- 3 4 1 0 0 0
- 3 15 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 8 1 0 0 0
- 4 17 1 0 0 0
- 5 6 1 0 0 0
- 5 18 1 0 0 0
- 5 19 1 0 0 0
- 6 7 1 0 0 0
- 6 20 1 0 0 0
- 6 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 7 24 1 0 0 0
- 8 9 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- M END
- $$$$
- dan056.hin
- OpenBabel0803D
- 12 12 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.3911 0.0000 0.0000 C 0 0 0 0 0
- 2.0865 1.2049 0.0000 C 0 0 0 0 0
- 1.3907 2.4094 0.0005 C 0 0 0 0 0
- -0.0005 2.4093 0.0008 C 0 0 0 0 0
- -0.6958 1.2045 0.0005 C 0 0 0 0 0
- -0.5472 -0.9481 -0.0003 H 0 0 0 0 0
- 1.9384 -0.9481 -0.0003 H 0 0 0 0 0
- 3.1812 1.2051 -0.0004 H 0 0 0 0 0
- 1.9379 3.3576 0.0006 H 0 0 0 0 0
- -0.5481 3.3572 0.0012 H 0 0 0 0 0
- -1.7906 1.2043 0.0005 H 0 0 0 0 0
- 1 2 2 0 0 0
- 1 6 1 0 0 0
- 1 7 1 0 0 0
- 2 3 1 0 0 0
- 2 8 1 0 0 0
- 3 4 2 0 0 0
- 3 9 1 0 0 0
- 4 5 1 0 0 0
- 4 10 1 0 0 0
- 5 6 2 0 0 0
- 5 11 1 0 0 0
- 6 12 1 0 0 0
- M END
- $$$$
- dan057.hin
- OpenBabel0803D
- 15 15 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.3900 0.0000 0.0000 C 0 0 0 0 0
- 2.0884 1.2114 0.0000 C 0 0 0 0 0
- 1.3846 2.4188 -0.0002 C 0 0 0 0 0
- -0.0058 2.4089 -0.0001 C 0 0 0 0 0
- -0.6987 1.2027 0.0000 C 0 0 0 0 0
- 3.5686 1.1755 -0.0010 C 0 0 0 0 0
- 4.2121 2.3684 0.0314 O 0 0 0 0 0
- 4.3045 0.2020 -0.0270 O 0 0 0 0 0
- -0.5441 -0.9504 0.0000 H 0 0 0 0 0
- 1.9400 -0.9496 -0.0004 H 0 0 0 0 0
- 1.9181 3.3766 -0.0005 H 0 0 0 0 0
- -0.5561 3.3558 -0.0002 H 0 0 0 0 0
- -1.7939 1.2002 0.0001 H 0 0 0 0 0
- 5.1520 2.2149 0.0267 H 0 0 0 0 0
- 1 2 2 0 0 0
- 1 6 1 0 0 0
- 1 10 1 0 0 0
- 2 3 1 0 0 0
- 2 11 1 0 0 0
- 3 4 2 0 0 0
- 3 7 1 0 0 0
- 4 5 1 0 0 0
- 4 12 1 0 0 0
- 5 6 2 0 0 0
- 5 13 1 0 0 0
- 6 14 1 0 0 0
- 7 8 1 0 0 0
- 7 9 2 0 0 0
- 8 15 1 0 0 0
- M END
- $$$$
- dan058.hin
- OpenBabel0803D
- 18 18 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5209 0.0000 0.0000 C 0 0 0 0 0
- 2.0663 1.4198 0.0000 C 0 0 0 0 0
- 1.5207 2.2135 1.1772 C 0 0 0 0 0
- -0.0002 2.2138 1.1763 C 0 0 0 0 0
- -0.5456 0.7940 1.1769 C 0 0 0 0 0
- -0.3762 0.4288 -0.9501 H 0 0 0 0 0
- 1.8973 -0.5479 0.8868 H 0 0 0 0 0
- 1.8964 1.7839 2.1271 H 0 0 0 0 0
- -0.3805 2.7671 2.0563 H 0 0 0 0 0
- -0.2800 0.2891 2.1270 H 0 0 0 0 0
- -0.3796 -1.0391 0.0343 H 0 0 0 0 0
- 1.9005 -0.5526 -0.8807 H 0 0 0 0 0
- 3.1724 1.4018 0.0341 H 0 0 0 0 0
- 1.8006 1.9249 -0.9500 H 0 0 0 0 0
- 1.9009 3.2524 1.1435 H 0 0 0 0 0
- -0.3760 2.7609 0.2888 H 0 0 0 0 0
- -1.6517 0.8121 1.1426 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 6 1 0 0 0
- 1 7 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 8 1 0 0 0
- 2 13 1 0 0 0
- 3 4 1 0 0 0
- 3 14 1 0 0 0
- 3 15 1 0 0 0
- 4 5 1 0 0 0
- 4 9 1 0 0 0
- 4 16 1 0 0 0
- 5 6 1 0 0 0
- 5 10 1 0 0 0
- 5 17 1 0 0 0
- 6 11 1 0 0 0
- 6 18 1 0 0 0
- M END
- $$$$
- dan059.hin
- OpenBabel0803D
- 32 31 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5120 0.0000 0.0000 C 0 0 0 0 0
- 2.0695 1.4145 0.0000 C 0 0 0 0 0
- 3.5897 1.4110 -0.0001 C 0 0 0 0 0
- 4.1460 2.8257 0.0072 C 0 0 0 0 0
- 5.6661 2.8215 0.0032 C 0 0 0 0 0
- 6.2231 4.2359 0.0157 C 0 0 0 0 0
- 7.7432 4.2311 0.0109 C 0 0 0 0 0
- 8.3027 5.6447 0.0241 C 0 0 0 0 0
- 9.8147 5.6417 0.0232 C 0 0 0 0 0
- -0.3985 -1.0225 -0.0001 H 0 0 0 0 0
- -0.4051 0.5101 0.8842 H 0 0 0 0 0
- -0.4050 0.5102 -0.8841 H 0 0 0 0 0
- 1.8902 -0.5539 0.8823 H 0 0 0 0 0
- 1.8903 -0.5539 -0.8823 H 0 0 0 0 0
- 1.6918 1.9688 -0.8827 H 0 0 0 0 0
- 1.6912 1.9691 0.8823 H 0 0 0 0 0
- 3.9670 0.8517 0.8797 H 0 0 0 0 0
- 3.9666 0.8603 -0.8855 H 0 0 0 0 0
- 3.7668 3.3860 -0.8713 H 0 0 0 0 0
- 3.7709 3.3754 0.8940 H 0 0 0 0 0
- 6.0454 2.2577 0.8794 H 0 0 0 0 0
- 6.0407 2.2749 -0.8858 H 0 0 0 0 0
- 5.8438 4.7997 -0.8604 H 0 0 0 0 0
- 5.8488 4.7824 0.9048 H 0 0 0 0 0
- 8.1232 3.6668 0.8864 H 0 0 0 0 0
- 8.1177 3.6854 -0.8785 H 0 0 0 0 0
- 7.9250 6.2073 -0.8529 H 0 0 0 0 0
- 7.9256 6.1909 0.9116 H 0 0 0 0 0
- 10.2155 6.6634 0.0314 H 0 0 0 0 0
- 10.2194 5.1233 0.9028 H 0 0 0 0 0
- 10.2180 5.1380 -0.8654 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 1 13 1 0 0 0
- 2 3 1 0 0 0
- 2 14 1 0 0 0
- 2 15 1 0 0 0
- 3 4 1 0 0 0
- 3 16 1 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 4 19 1 0 0 0
- 5 6 1 0 0 0
- 5 20 1 0 0 0
- 5 21 1 0 0 0
- 6 7 1 0 0 0
- 6 22 1 0 0 0
- 6 23 1 0 0 0
- 7 8 1 0 0 0
- 7 24 1 0 0 0
- 7 25 1 0 0 0
- 8 9 1 0 0 0
- 8 26 1 0 0 0
- 8 27 1 0 0 0
- 9 10 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- 10 30 1 0 0 0
- 10 31 1 0 0 0
- 10 32 1 0 0 0
- M END
- $$$$
- dan060.hin
- OpenBabel0803D
- 5 4 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.9511 0.0000 0.0000 Br 0 0 0 0 0
- -0.3450 1.0343 0.0000 H 0 0 0 0 0
- -0.3447 -0.5170 -0.8960 H 0 0 0 0 0
- -0.3450 -0.5175 0.8955 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 3 1 0 0 0
- 1 4 1 0 0 0
- 1 5 1 0 0 0
- M END
- $$$$
- dan061.hin
- OpenBabel0803D
- 13 12 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5122 0.0000 0.0000 C 0 0 0 0 0
- 2.0567 1.4244 0.0000 C 0 0 0 0 0
- 3.5344 1.4259 -0.0710 N 0 0 0 0 0
- -0.3972 -1.0230 0.0048 H 0 0 0 0 0
- -0.4073 0.5137 0.8811 H 0 0 0 0 0
- -0.4054 0.5045 -0.8872 H 0 0 0 0 0
- 1.8868 -0.5562 0.8832 H 0 0 0 0 0
- 1.8887 -0.5551 -0.8822 H 0 0 0 0 0
- 1.6850 1.9743 -0.8881 H 0 0 0 0 0
- 1.6670 1.9734 0.8856 H 0 0 0 0 0
- 3.8653 2.3660 -0.0168 H 0 0 0 0 0
- 3.9104 0.9042 0.6935 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 5 1 0 0 0
- 1 6 1 0 0 0
- 1 7 1 0 0 0
- 2 3 1 0 0 0
- 2 8 1 0 0 0
- 2 9 1 0 0 0
- 3 4 1 0 0 0
- 3 10 1 0 0 0
- 3 11 1 0 0 0
- 4 12 1 0 0 0
- 4 13 1 0 0 0
- M END
- $$$$
- dan062.hin
- OpenBabel0803D
- 29 28 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.5122 0.0000 0.0000 C 0 0 0 0 0
- 2.0661 1.4164 0.0000 C 0 0 0 0 0
- 3.5982 1.4384 0.0179 C 0 0 0 0 0
- 4.1768 2.7653 -0.5470 C 0 0 0 0 0
- 5.7053 2.6846 -0.5619 C 0 0 0 0 0
- 3.6969 2.9651 -1.9863 C 0 0 0 0 0
- 3.7494 3.9685 0.2904 C 0 0 0 0 0
- 4.1096 1.1455 1.4221 C 0 0 0 0 0
- -0.3983 -1.0226 -0.0006 H 0 0 0 0 0
- -0.4057 0.5096 0.8842 H 0 0 0 0 0
- -0.4051 0.5104 -0.8840 H 0 0 0 0 0
- 1.8900 -0.5551 0.8823 H 0 0 0 0 0
- 1.8892 -0.5543 -0.8827 H 0 0 0 0 0
- 1.6957 1.9578 -0.9004 H 0 0 0 0 0
- 1.6631 1.9782 0.8674 H 0 0 0 0 0
- 3.9662 0.6264 -0.6599 H 0 0 0 0 0
- 6.1536 3.6369 -0.8724 H 0 0 0 0 0
- 6.0973 2.4355 0.4378 H 0 0 0 0 0
- 6.0606 1.9093 -1.2538 H 0 0 0 0 0
- 4.0592 3.9148 -2.4002 H 0 0 0 0 0
- 4.0495 2.1600 -2.6445 H 0 0 0 0 0
- 2.5958 2.9731 -2.0378 H 0 0 0 0 0
- 4.1521 4.9035 -0.1220 H 0 0 0 0 0
- 2.6560 4.0673 0.3232 H 0 0 0 0 0
- 4.1064 3.8853 1.3257 H 0 0 0 0 0
- 5.2016 1.2848 1.4826 H 0 0 0 0 0
- 3.6561 1.8058 2.1744 H 0 0 0 0 0
- 3.8871 0.1121 1.7188 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 10 1 0 0 0
- 1 11 1 0 0 0
- 1 12 1 0 0 0
- 2 3 1 0 0 0
- 2 13 1 0 0 0
- 2 14 1 0 0 0
- 3 4 1 0 0 0
- 3 15 1 0 0 0
- 3 16 1 0 0 0
- 4 5 1 0 0 0
- 4 9 1 0 0 0
- 4 17 1 0 0 0
- 5 6 1 0 0 0
- 5 7 1 0 0 0
- 5 8 1 0 0 0
- 6 18 1 0 0 0
- 6 19 1 0 0 0
- 6 20 1 0 0 0
- 7 21 1 0 0 0
- 7 22 1 0 0 0
- 7 23 1 0 0 0
- 8 24 1 0 0 0
- 8 25 1 0 0 0
- 8 26 1 0 0 0
- 9 27 1 0 0 0
- 9 28 1 0 0 0
- 9 29 1 0 0 0
- M END
- $$$$
- dan063.hin
- OpenBabel0803D
- 10 10 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 N 0 0 0 0 0
- 1.3969 0.0000 0.0000 C 0 0 0 0 0
- 1.8042 1.3289 0.0000 C 0 0 0 0 0
- 0.6422 2.1467 0.0007 C 0 0 0 0 0
- -0.4713 1.3150 0.0011 C 0 0 0 0 0
- -0.5671 -0.8058 0.0017 H 0 0 0 0 0
- 2.0022 -0.9050 -0.0004 H 0 0 0 0 0
- 2.8305 1.6853 -0.0004 H 0 0 0 0 0
- 0.6313 3.2330 0.0010 H 0 0 0 0 0
- -1.5274 1.5795 0.0016 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 5 1 0 0 0
- 1 6 1 0 0 0
- 2 3 2 0 0 0
- 2 7 1 0 0 0
- 3 4 1 0 0 0
- 3 8 1 0 0 0
- 4 5 2 0 0 0
- 4 9 1 0 0 0
- 5 10 1 0 0 0
- M END
- $$$$
- dan064.hin
- OpenBabel0803D
- 24 26 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.3599 0.0000 0.0000 C 0 0 0 0 0
- 2.0839 1.2278 0.0000 C 0 0 0 0 0
- 1.4263 2.4182 0.0010 C 0 0 0 0 0
- -0.0064 2.4586 0.0018 C 0 0 0 0 0
- -0.7284 1.2342 0.0009 C 0 0 0 0 0
- -2.1252 1.2527 0.0012 C 0 0 0 0 0
- -2.8177 2.4657 0.0029 C 0 0 0 0 0
- -2.0958 3.6903 0.0044 C 0 0 0 0 0
- -0.6990 3.6717 0.0037 C 0 0 0 0 0
- -4.2504 2.5055 0.0032 C 0 0 0 0 0
- -4.9083 3.6956 0.0054 C 0 0 0 0 0
- -4.1845 4.9234 0.0073 C 0 0 0 0 0
- -2.8245 4.9244 0.0067 C 0 0 0 0 0
- -0.5654 -0.9388 -0.0005 H 0 0 0 0 0
- 1.9207 -0.9404 -0.0004 H 0 0 0 0 0
- 3.1781 1.1918 -0.0007 H 0 0 0 0 0
- 1.9745 3.3671 0.0012 H 0 0 0 0 0
- -2.6821 0.3076 0.0001 H 0 0 0 0 0
- -0.1419 4.6167 0.0046 H 0 0 0 0 0
- -4.7981 1.5563 0.0018 H 0 0 0 0 0
- -6.0026 3.7315 0.0057 H 0 0 0 0 0
- -4.7459 5.8634 0.0092 H 0 0 0 0 0
- -2.2595 5.8634 0.0081 H 0 0 0 0 0
- 1 2 2 0 0 0
- 1 6 1 0 0 0
- 1 15 1 0 0 0
- 2 3 1 0 0 0
- 2 16 1 0 0 0
- 3 4 2 0 0 0
- 3 17 1 0 0 0
- 4 5 1 0 0 0
- 4 18 1 0 0 0
- 5 6 2 0 0 0
- 5 10 1 0 0 0
- 6 7 1 0 0 0
- 7 8 2 0 0 0
- 7 19 1 0 0 0
- 8 9 1 0 0 0
- 8 11 1 0 0 0
- 9 10 2 0 0 0
- 9 14 1 0 0 0
- 10 20 1 0 0 0
- 11 12 2 0 0 0
- 11 21 1 0 0 0
- 12 13 1 0 0 0
- 12 22 1 0 0 0
- 13 14 2 0 0 0
- 13 23 1 0 0 0
- 14 24 1 0 0 0
- M END
- $$$$
- dan065.hin
- OpenBabel0803D
- 8 7 0 0 0 0 0 0 0 0999 V2000
- 0.0000 0.0000 0.0000 C 0 0 0 0 0
- 1.4966 0.0000 0.0000 C 0 0 0 0 0
- 2.2578 0.9517 0.0000 O 0 0 0 0 0
- 2.0845 -1.2203 0.0035 O 0 0 0 0 0
- -0.4238 -1.0087 -0.0915 H 0 0 0 0 0
- -0.3773 0.4429 0.9313 H 0 0 0 0 0
- -0.3811 0.6031 -0.8346 H 0 0 0 0 0
- 3.0314 -1.1194 0.0044 H 0 0 0 0 0
- 1 2 1 0 0 0
- 1 5 1 0 0 0
- 1 6 1 0 0 0
- 1 7 1 0 0 0
- 2 3 2 0 0 0
- 2 4 1 0 0 0
- 4 8 1 0 0 0
- M END