3BT Converted by convert_cif2sdf.py 2024/03/29 11:09:15 36 36 0 0 0 0 0 0 0 0999 V2000 -3.1333 0.1251 -0.3197 C 0 0 0 0 0 -2.0062 -0.1113 -1.3256 C 0 0 0 0 0 -6.7918 1.8415 0.0649 N 0 0 0 0 0 -5.2983 0.6516 1.3846 N 0 0 0 0 0 -5.5961 1.1838 0.2316 C 0 0 0 0 0 -4.4652 1.0583 -1.1133 S 0 0 0 0 0 1.1450 -0.9338 0.5821 C 0 0 0 0 0 0.1312 -0.2203 -0.0275 C 0 0 0 0 0 -0.8969 -0.8894 -0.6643 C 0 0 0 0 0 -0.9058 -2.2710 -0.7003 C 0 0 0 0 0 0.1112 -2.9844 -0.0936 C 0 0 0 0 0 1.1360 -2.3163 0.5471 C 0 0 0 0 0 3.3949 0.0670 0.2893 C 0 0 0 0 0 2.2629 -0.2054 1.2818 C 0 0 0 0 0 7.0748 1.7545 -0.0073 N 0 0 0 0 0 5.5672 0.6531 -1.3855 N 0 0 0 0 0 5.8707 1.1205 -0.2063 C 0 0 0 0 0 4.7371 0.9412 1.1304 S 0 0 0 0 0 -2.7503 0.6888 0.5294 H 0 0 0 0 0 -3.5184 -0.8348 0.0255 H 0 0 0 0 0 -2.3891 -0.6770 -2.1757 H 0 0 0 0 0 -1.6200 0.8466 -1.6718 H 0 0 0 0 0 -7.4146 1.9112 0.8061 H 0 0 0 0 0 -7.0118 2.2401 -0.7902 H 0 0 0 0 0 -4.4545 0.1882 1.5016 H 0 0 0 0 0 0.1384 0.8584 -0.0006 H 0 0 0 0 0 -1.7072 -2.7932 -1.2015 H 0 0 0 0 0 0.1040 -4.0641 -0.1204 H 0 0 0 0 0 1.9303 -2.8738 1.0215 H 0 0 0 0 0 3.7681 -0.8785 -0.1035 H 0 0 0 0 0 3.0186 0.6789 -0.5300 H 0 0 0 0 0 1.8896 0.7390 1.6766 H 0 0 0 0 0 2.6390 -0.8184 2.1021 H 0 0 0 0 0 7.6986 1.8527 -0.7432 H 0 0 0 0 0 7.3011 2.1025 0.8689 H 0 0 0 0 0 6.1909 0.7513 -2.1214 H 0 0 0 0 0 1 2 1 0 0 0 1 6 1 0 0 0 1 19 1 0 0 0 1 20 1 0 0 0 2 9 1 0 0 0 2 21 1 0 0 0 2 22 1 0 0 0 3 5 1 0 0 0 3 23 1 0 0 0 3 24 1 0 0 0 4 5 2 0 0 0 4 25 1 0 0 0 5 6 1 0 0 0 7 8 2 0 0 0 7 12 1 0 0 0 7 14 1 0 0 0 8 9 1 0 0 0 8 26 1 0 0 0 9 10 2 0 0 0 10 11 1 0 0 0 10 27 1 0 0 0 11 12 2 0 0 0 11 28 1 0 0 0 12 29 1 0 0 0 13 14 1 0 0 0 13 18 1 0 0 0 13 30 1 0 0 0 13 31 1 0 0 0 14 32 1 0 0 0 14 33 1 0 0 0 15 17 1 0 0 0 15 34 1 0 0 0 15 35 1 0 0 0 16 17 2 0 0 0 16 36 1 0 0 0 17 18 1 0 0 0 M END $$$$