94I Converted by convert_cif2sdf.py 2026/01/30 11:05:38 47 49 0 0 0 0 0 0 0 0999 V2000 -1.0227 -0.2955 -0.2204 C 0 0 0 0 0 -0.9251 -2.7530 0.2608 C 0 0 0 0 0 0.8300 -4.0068 -0.5307 C 0 0 0 0 0 -2.1600 2.1408 -0.0175 C 0 0 0 0 0 1.6057 -0.0734 1.0011 C 0 0 0 0 0 2.9008 -0.6869 0.7284 C 0 0 0 0 0 4.0045 0.3775 0.5353 C 0 0 0 0 0 1.7333 2.0959 0.0184 C 0 0 0 0 0 2.9874 2.2399 -0.8644 C 0 0 0 0 0 -6.5299 0.0277 -0.1232 C 0 0 0 0 0 -0.8356 2.0574 -0.0110 N 0 0 0 0 0 -5.1525 -0.0579 -0.1159 N 0 0 0 0 0 -7.2897 -1.1179 -0.1084 N 0 0 0 0 0 -4.9490 2.1544 -0.1480 O 0 0 0 0 0 -4.4074 1.0652 -0.1304 C 0 0 0 0 0 -7.1098 1.1939 -0.1424 N 0 0 0 0 0 -2.9370 0.9737 -0.1224 C 0 0 0 0 0 -2.3432 -0.2138 -0.2209 N 0 0 0 0 0 -2.7756 3.3741 0.0854 N 0 0 0 0 0 -0.2442 0.8753 -0.1094 C 0 0 0 0 0 -0.3621 -1.6174 -0.3292 C 0 0 0 0 0 -0.3019 -3.9120 0.1390 N 0 0 0 0 0 1.3967 -2.9610 -1.0984 N 0 0 0 0 0 0.8412 -1.7631 -1.0256 C 0 0 0 0 0 1.1341 0.7886 -0.1031 N 0 0 0 0 0 3.8688 0.9738 -0.8399 C 0 0 0 0 0 -1.8510 -2.6826 0.8112 H 0 0 0 0 0 1.3111 -4.9702 -0.6111 H 0 0 0 0 0 0.8724 -0.8621 1.1678 H 0 0 0 0 0 1.6852 0.5285 1.9057 H 0 0 0 0 0 3.1717 -1.3320 1.5646 H 0 0 0 0 0 3.8917 1.1598 1.2857 H 0 0 0 0 0 2.0115 2.2626 1.0594 H 0 0 0 0 0 1.0039 2.8488 -0.2791 H 0 0 0 0 0 2.6768 2.4331 -1.8913 H 0 0 0 0 0 3.5745 3.0862 -0.5087 H 0 0 0 0 0 -4.7212 -0.9267 -0.1013 H 0 0 0 0 0 -6.8583 -1.9856 -0.0938 H 0 0 0 0 0 -8.2582 -1.0570 -0.1134 H 0 0 0 0 0 -8.0784 1.2538 -0.1475 H 0 0 0 0 0 -2.2440 4.1695 0.2395 H 0 0 0 0 0 -3.7396 3.4428 0.0026 H 0 0 0 0 0 1.3103 -0.9113 -1.4959 H 0 0 0 0 0 4.8610 1.2297 -1.2105 H 0 0 0 0 0 3.4306 0.2282 -1.5029 H 0 0 0 0 0 2.8263 -1.2895 -0.1762 H 0 0 0 0 0 4.9836 -0.0895 0.6379 H 0 0 0 0 0 19 4 1 0 0 0 14 15 2 0 0 0 16 10 2 0 0 0 4 11 2 0 0 0 4 17 1 0 0 0 15 17 1 0 0 0 15 12 1 0 0 0 11 20 1 0 0 0 17 18 2 0 0 0 10 12 1 0 0 0 10 13 1 0 0 0 9 8 1 0 0 0 9 26 1 0 0 0 8 25 1 0 0 0 20 25 1 0 0 0 20 1 2 0 0 0 26 7 1 0 0 0 18 1 1 0 0 0 25 5 1 0 0 0 1 21 1 0 0 0 5 6 1 0 0 0 7 6 1 0 0 0 21 2 2 0 0 0 21 24 1 0 0 0 2 22 1 0 0 0 24 23 2 0 0 0 22 3 2 0 0 0 23 3 1 0 0 0 2 27 1 0 0 0 3 28 1 0 0 0 5 29 1 0 0 0 5 30 1 0 0 0 6 31 1 0 0 0 7 32 1 0 0 0 8 33 1 0 0 0 8 34 1 0 0 0 9 35 1 0 0 0 9 36 1 0 0 0 12 37 1 0 0 0 13 38 1 0 0 0 13 39 1 0 0 0 16 40 1 0 0 0 19 41 1 0 0 0 19 42 1 0 0 0 24 43 1 0 0 0 26 44 1 0 0 0 26 45 1 0 0 0 6 46 1 0 0 0 7 47 1 0 0 0 M END $$$$