J54 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 31 31 0 0 0 0 0 0 0 0999 V2000 -5.7439 0.9408 0.1588 O 0 0 0 0 0 -4.9689 0.0357 0.3606 C 0 0 0 0 0 -3.5482 0.3357 0.7628 C 0 0 0 0 0 -3.3937 1.7431 0.9516 O 0 0 0 0 0 -2.5958 -0.1387 -0.3366 C 0 0 0 0 0 -1.2107 0.0428 0.1046 N 0 0 0 0 0 -0.1933 -0.3083 -0.7063 C 0 0 0 0 0 -0.4243 -0.7761 -1.8048 O 0 0 0 0 0 1.0807 -0.1414 -0.2998 N 0 0 0 0 0 2.1869 -0.5223 -1.1813 C 0 0 0 0 0 3.4975 -0.2360 -0.4962 C 0 0 0 0 0 4.0938 -1.2061 0.2887 C 0 0 0 0 0 5.2966 -0.9432 0.9180 C 0 0 0 0 0 5.9031 0.2898 0.7623 C 0 0 0 0 0 5.3078 1.2590 -0.0231 C 0 0 0 0 0 4.1079 0.9945 -0.6556 C 0 0 0 0 0 -5.3754 -1.2365 0.2301 O 0 0 0 0 0 -3.3165 -0.1836 1.6926 H 0 0 0 0 0 -6.2975 -1.3793 -0.0263 H 0 0 0 0 0 -3.5832 2.2696 0.1633 H 0 0 0 0 0 -2.7753 -1.1938 -0.5432 H 0 0 0 0 0 -2.7676 0.4431 -1.2421 H 0 0 0 0 0 -1.0256 0.4163 0.9803 H 0 0 0 0 0 1.2657 0.2321 0.5759 H 0 0 0 0 0 2.1207 -1.5870 -1.4081 H 0 0 0 0 0 2.1285 0.0500 -2.1070 H 0 0 0 0 0 3.6203 -2.1685 0.4111 H 0 0 0 0 0 3.6438 1.7503 -1.2724 H 0 0 0 0 0 5.7616 -1.6998 1.5320 H 0 0 0 0 0 6.8426 0.4950 1.2549 H 0 0 0 0 0 5.7814 2.2209 -0.1445 H 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 2 17 1 0 0 0 3 4 1 0 0 0 3 5 1 0 0 0 3 18 1 0 0 0 4 20 1 0 0 0 5 6 1 0 0 0 5 21 1 0 0 0 5 22 1 0 0 0 6 7 1 0 0 0 6 23 1 0 0 0 7 8 2 0 0 0 7 9 1 0 0 0 9 10 1 0 0 0 9 24 1 0 0 0 10 11 1 0 0 0 10 25 1 0 0 0 10 26 1 0 0 0 11 12 1 0 0 0 11 16 2 0 0 0 12 13 2 0 0 0 12 27 1 0 0 0 13 14 1 0 0 0 13 29 1 0 0 0 14 15 2 0 0 0 14 30 1 0 0 0 15 16 1 0 0 0 15 31 1 0 0 0 16 28 1 0 0 0 17 19 1 0 0 0 M END $$$$