95H Converted by convert_cif2sdf.py 2024/03/29 11:09:15 49 50 0 0 0 0 0 0 0 0999 V2000 -2.2867 -3.0789 0.4268 O 0 0 0 0 0 -2.7535 3.3552 0.7528 O 0 0 0 0 0 -4.3308 0.0147 0.0778 C 0 0 0 0 0 -1.0295 -2.5678 -0.0204 C 0 0 0 0 0 -1.6970 1.1066 2.0424 O 0 0 0 0 0 -4.2188 1.4335 0.6412 C 0 0 0 0 0 -2.9007 2.0584 0.1720 C 0 0 0 0 0 -1.7381 1.1632 0.6158 C 0 0 0 0 0 -1.9464 -0.2458 0.0536 C 0 0 0 0 0 1.5955 -0.9334 0.7580 C 0 0 0 0 0 2.8959 -0.4050 0.2946 C 0 0 0 0 0 4.0647 -0.7095 0.9934 C 0 0 0 0 0 5.2755 -0.2136 0.5551 C 0 0 0 0 0 5.3316 0.5851 -0.5730 C 0 0 0 0 0 4.1768 0.8922 -1.2695 C 0 0 0 0 0 2.9606 0.3965 -0.8462 C 0 0 0 0 0 -4.8034 -1.6152 -2.1982 C 0 0 0 0 0 -0.8212 -1.1600 0.5408 C 0 0 0 0 0 0.0957 -3.4831 0.4669 C 0 0 0 0 0 0.4674 -0.6365 0.0813 N 0 0 0 0 0 6.6340 1.1145 -1.0367 N 0 3 0 0 0 1.5423 -1.6352 1.7489 O 0 0 0 0 0 -5.3137 2.2216 0.1710 O 0 0 0 0 0 6.6870 1.8181 -2.0297 O 0 0 0 0 0 7.6526 0.8466 -0.4249 O 0 5 0 0 0 -3.2036 -0.7546 0.5026 O 0 0 0 0 0 -4.3680 0.0840 -1.7342 S 0 0 0 0 0 -2.3655 -3.1412 1.3889 H 0 0 0 0 0 -3.4598 3.9730 0.5193 H 0 0 0 0 0 -5.2461 -0.4500 0.4434 H 0 0 0 0 0 -1.0198 -2.5291 -1.1099 H 0 0 0 0 0 -1.5717 1.9667 2.4664 H 0 0 0 0 0 -4.2376 1.3966 1.7307 H 0 0 0 0 0 -2.9028 2.1425 -0.9144 H 0 0 0 0 0 -0.8009 1.5718 0.2390 H 0 0 0 0 0 -1.9376 -0.2071 -1.0358 H 0 0 0 0 0 4.0228 -1.3331 1.8741 H 0 0 0 0 0 6.1812 -0.4485 1.0943 H 0 0 0 0 0 4.2267 1.5173 -2.1485 H 0 0 0 0 0 2.0596 0.6325 -1.3937 H 0 0 0 0 0 -5.7714 -1.8724 -1.7688 H 0 0 0 0 0 -4.8551 -1.6925 -3.2846 H 0 0 0 0 0 -4.0445 -2.3007 -1.8211 H 0 0 0 0 0 -0.8309 -1.1987 1.6303 H 0 0 0 0 0 -0.0518 -4.4860 0.0663 H 0 0 0 0 0 1.0553 -3.0940 0.1251 H 0 0 0 0 0 0.0870 -3.5217 1.5563 H 0 0 0 0 0 0.5092 -0.0768 -0.7094 H 0 0 0 0 0 -6.1817 1.8837 0.4310 H 0 0 0 0 0 5 8 1 0 0 0 2 7 1 0 0 0 6 23 1 0 0 0 6 7 1 0 0 0 6 3 1 0 0 0 7 8 1 0 0 0 3 26 1 0 0 0 3 27 1 0 0 0 8 9 1 0 0 0 26 9 1 0 0 0 9 18 1 0 0 0 22 10 2 0 0 0 18 4 1 0 0 0 18 20 1 0 0 0 17 27 1 0 0 0 4 1 1 0 0 0 4 19 1 0 0 0 10 20 1 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 11 16 1 0 0 0 12 13 1 0 0 0 16 15 2 0 0 0 13 14 2 0 0 0 15 14 1 0 0 0 14 21 1 0 0 0 21 25 1 0 0 0 21 24 2 0 0 0 1 28 1 0 0 0 2 29 1 0 0 0 3 30 1 0 0 0 4 31 1 0 0 0 5 32 1 0 0 0 6 33 1 0 0 0 7 34 1 0 0 0 8 35 1 0 0 0 9 36 1 0 0 0 12 37 1 0 0 0 13 38 1 0 0 0 15 39 1 0 0 0 16 40 1 0 0 0 17 41 1 0 0 0 17 42 1 0 0 0 17 43 1 0 0 0 18 44 1 0 0 0 19 45 1 0 0 0 19 46 1 0 0 0 19 47 1 0 0 0 20 48 1 0 0 0 23 49 1 0 0 0 M END $$$$