0RR Converted by convert_cif2sdf.py 2024/03/01 05:07:52 45 48 0 0 0 0 0 0 0 0999 V2000 7.9225 0.7742 0.3875 O 0 0 0 0 0 6.9593 0.1955 -0.3456 C 0 0 0 0 0 7.1457 -0.0292 -1.5183 O 0 0 0 0 0 5.6452 -0.1724 0.2923 C 0 0 0 0 0 4.7304 -0.8111 -0.7550 C 0 0 0 0 0 3.4525 -1.1697 -0.1350 N 0 0 0 0 0 2.4551 -0.3017 -0.1177 C 0 0 0 0 0 2.5433 0.8096 -0.6029 O 0 0 0 0 0 3.2869 -2.3792 0.4125 C 0 0 0 0 0 4.4503 -3.6326 0.4817 S 0 0 0 0 0 1.6350 -2.4382 1.0521 S 0 0 0 0 0 1.2226 -0.7906 0.5395 C 0 0 0 0 0 0.0281 -0.1194 0.7132 C 0 0 0 0 0 -1.2522 -0.6738 1.1992 C 0 0 0 0 0 -1.4538 -1.8278 1.5258 O 0 0 0 0 0 -0.2446 1.3111 0.4610 C 0 0 0 0 0 0.5414 2.3661 0.0039 C 0 0 0 0 0 -0.0132 3.6231 -0.1324 C 0 0 0 0 0 0.9598 4.9426 -0.7021 CL 0 0 0 0 0 -1.3463 3.8334 0.1857 C 0 0 0 0 0 -2.1324 2.7933 0.6403 C 0 0 0 0 0 -1.5937 1.5201 0.7839 C 0 0 0 0 0 -2.1540 0.3228 1.2155 N 0 0 0 0 0 -3.5479 0.1682 1.6393 C 0 0 0 0 0 -4.3600 -0.3901 0.4984 C 0 0 0 0 0 -4.5282 -1.7571 0.3733 C 0 0 0 0 0 -3.8032 -2.8303 1.5284 CL 0 0 0 0 0 -5.2743 -2.2679 -0.6742 C 0 0 0 0 0 -5.8522 -1.4133 -1.5942 C 0 0 0 0 0 -5.6841 -0.0472 -1.4689 C 0 0 0 0 0 -4.9428 0.4661 -0.4197 C 0 0 0 0 0 -4.7375 2.1825 -0.2580 CL 0 0 0 0 0 8.7493 0.9920 -0.0658 H 0 0 0 0 0 5.8202 -0.8815 1.1021 H 0 0 0 0 0 5.1703 0.7237 0.6904 H 0 0 0 0 0 4.5553 -0.1030 -1.5646 H 0 0 0 0 0 5.2053 -1.7083 -1.1539 H 0 0 0 0 0 1.5792 2.2009 -0.2430 H 0 0 0 0 0 -1.7726 4.8192 0.0777 H 0 0 0 0 0 -3.1696 2.9704 0.8853 H 0 0 0 0 0 -3.5959 -0.5143 2.4875 H 0 0 0 0 0 -3.9489 1.1388 1.9295 H 0 0 0 0 0 -5.4056 -3.3361 -0.7727 H 0 0 0 0 0 -6.4343 -1.8133 -2.4107 H 0 0 0 0 0 -6.1349 0.6206 -2.1889 H 0 0 0 0 0 3 2 2 0 0 0 2 4 1 0 0 0 2 1 1 0 0 0 4 5 1 0 0 0 27 26 1 0 0 0 24 23 1 0 0 0 24 25 1 0 0 0 21 20 2 0 0 0 21 22 1 0 0 0 20 18 1 0 0 0 23 22 1 0 0 0 23 14 1 0 0 0 22 16 2 0 0 0 18 19 1 0 0 0 18 17 2 0 0 0 14 15 2 0 0 0 14 13 1 0 0 0 16 17 1 0 0 0 16 13 1 0 0 0 13 12 2 0 0 0 11 12 1 0 0 0 11 9 1 0 0 0 12 7 1 0 0 0 7 8 2 0 0 0 7 6 1 0 0 0 9 6 1 0 0 0 9 10 2 0 0 0 6 5 1 0 0 0 25 26 2 0 0 0 25 31 1 0 0 0 26 28 1 0 0 0 32 31 1 0 0 0 31 30 2 0 0 0 28 29 2 0 0 0 30 29 1 0 0 0 1 33 1 0 0 0 4 34 1 0 0 0 4 35 1 0 0 0 5 36 1 0 0 0 5 37 1 0 0 0 17 38 1 0 0 0 20 39 1 0 0 0 21 40 1 0 0 0 24 41 1 0 0 0 24 42 1 0 0 0 28 43 1 0 0 0 29 44 1 0 0 0 30 45 1 0 0 0 M END $$$$