C7H Converted by convert_cif2sdf.py 2024/03/29 11:09:15 43 46 0 0 0 0 0 0 0 0999 V2000 3.1721 -0.0007 0.6162 N 0 0 0 0 0 1.1043 1.2976 0.8123 C 0 0 0 0 0 2.4855 1.2130 0.1535 C 0 0 0 0 0 4.5790 -0.0023 0.1926 C 0 0 0 0 0 2.4849 -1.2160 0.1629 C 0 0 0 0 0 1.1028 -1.2954 0.8217 C 0 0 0 0 0 0.3707 0.0003 0.5443 C 0 0 0 0 0 -0.8878 -0.0012 0.0771 C 0 0 0 0 0 -1.6001 1.2696 -0.1925 C 0 0 0 0 0 -1.0732 2.1856 -1.0975 C 0 0 0 0 0 -1.7627 3.3473 -1.3842 C 0 0 0 0 0 -2.9818 3.6030 -0.7770 C 0 0 0 0 0 -3.5110 2.7160 0.1349 C 0 0 0 0 0 -2.8159 1.5443 0.4599 C 0 0 0 0 0 -3.3381 0.6593 1.4962 C 0 0 0 0 0 -3.3350 -0.6577 1.5055 C 0 0 0 0 0 -2.8096 -1.5527 0.4776 C 0 0 0 0 0 -1.5984 -1.2724 -0.1890 C 0 0 0 0 0 -1.0774 -2.1814 -1.1049 C 0 0 0 0 0 -1.7679 -3.3387 -1.3983 C 0 0 0 0 0 -2.9849 -3.6010 -0.7880 C 0 0 0 0 0 -3.5098 -2.7210 0.1509 C 0 0 0 0 0 1.2178 1.4409 1.8867 H 0 0 0 0 0 0.5453 2.1314 0.3878 H 0 0 0 0 0 3.0728 2.0892 0.4258 H 0 0 0 0 0 2.3703 1.1748 -0.9299 H 0 0 0 0 0 4.6311 -0.0485 -0.8952 H 0 0 0 0 0 5.0642 0.9089 0.5419 H 0 0 0 0 0 5.0848 -0.8691 0.6181 H 0 0 0 0 0 2.3697 -1.1852 -0.9205 H 0 0 0 0 0 3.0716 -2.0908 0.4415 H 0 0 0 0 0 0.5432 -2.1316 0.4024 H 0 0 0 0 0 1.2163 -1.4311 1.8971 H 0 0 0 0 0 -0.1254 1.9888 -1.5753 H 0 0 0 0 0 -1.3500 4.0593 -2.0835 H 0 0 0 0 0 -3.5229 4.5058 -1.0217 H 0 0 0 0 0 -4.4632 2.9248 0.5996 H 0 0 0 0 0 -3.7796 1.1403 2.3563 H 0 0 0 0 0 -3.7705 -1.1307 2.3730 H 0 0 0 0 0 -0.1307 -1.9802 -1.5859 H 0 0 0 0 0 -1.3603 -4.0437 -2.1076 H 0 0 0 0 0 -3.5290 -4.4982 -1.0416 H 0 0 0 0 0 -4.4571 -2.9372 0.6218 H 0 0 0 0 0 20 19 2 0 0 0 20 21 1 0 0 0 19 18 1 0 0 0 11 10 2 0 0 0 11 12 1 0 0 0 10 9 1 0 0 0 21 22 2 0 0 0 18 8 1 0 0 0 18 17 2 0 0 0 12 13 2 0 0 0 9 8 1 0 0 0 9 14 2 0 0 0 8 7 2 0 0 0 7 6 1 0 0 0 7 2 1 0 0 0 6 5 1 0 0 0 2 3 1 0 0 0 22 17 1 0 0 0 1 5 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 17 16 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 16 15 2 0 0 0 2 23 1 0 0 0 2 24 1 0 0 0 3 25 1 0 0 0 3 26 1 0 0 0 4 27 1 0 0 0 4 28 1 0 0 0 4 29 1 0 0 0 5 30 1 0 0 0 5 31 1 0 0 0 6 32 1 0 0 0 6 33 1 0 0 0 10 34 1 0 0 0 11 35 1 0 0 0 12 36 1 0 0 0 13 37 1 0 0 0 15 38 1 0 0 0 16 39 1 0 0 0 19 40 1 0 0 0 20 41 1 0 0 0 21 42 1 0 0 0 22 43 1 0 0 0 M END $$$$