CJQ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 57 61 0 0 0 0 0 0 0 0999 V2000 -2.5573 1.5467 0.2859 C 0 0 0 0 0 -3.9706 1.5977 0.2038 C 0 0 0 0 0 -4.9221 0.5373 -0.1400 C 0 0 0 0 0 -6.1903 -1.2688 -1.1663 C 0 0 0 0 0 -4.8291 -0.9395 -0.5226 C 0 0 0 0 0 -4.6087 -1.7993 0.7232 C 0 0 0 0 0 -4.3976 -3.2349 0.3126 C 0 0 0 0 0 -0.4678 0.4293 0.1360 C 0 0 0 0 0 0.1351 0.8050 -1.2190 C 0 0 0 0 0 1.6599 0.8424 -1.1046 C 0 0 0 0 0 2.1749 -0.5348 -0.6825 C 0 0 0 0 0 1.5708 -0.9115 0.6725 C 0 0 0 0 0 0.0460 -0.9489 0.5591 C 0 0 0 0 0 5.7157 -1.7745 -0.3541 C 0 0 0 0 0 4.1877 -1.8523 -0.4031 C 0 0 0 0 0 -4.4222 -3.5390 -0.8615 O 0 0 0 0 0 -4.1828 -4.1790 1.2491 N 0 0 0 0 0 -7.1103 -0.2326 -0.4901 C 0 0 0 0 0 -6.1889 0.9273 -0.1226 C 0 0 0 0 0 -4.5941 2.8107 0.4789 C 0 0 0 0 0 -6.3313 2.6287 0.3161 S 0 0 0 0 0 -3.8429 3.8712 0.8061 N 0 0 0 0 0 -2.5353 3.7747 0.8698 C 0 0 0 0 0 -1.8986 2.6429 0.6232 N 0 0 0 0 0 -1.8927 0.3944 0.0301 O 0 0 0 0 0 3.6390 -0.4995 -0.5734 N 0 0 0 0 0 6.1113 -0.8933 0.7006 O 0 0 0 0 0 5.5941 0.4335 0.5657 C 0 0 0 0 0 4.0637 0.3785 0.5273 C 0 0 0 0 0 -6.1591 -1.1166 -2.2454 H 0 0 0 0 0 -6.5016 -2.2852 -0.9259 H 0 0 0 0 0 -4.0236 -1.0961 -1.2403 H 0 0 0 0 0 -3.7300 -1.4427 1.2600 H 0 0 0 0 0 -5.4828 -1.7322 1.3705 H 0 0 0 0 0 -0.1777 1.1696 0.8812 H 0 0 0 0 0 -0.1560 0.0648 -1.9642 H 0 0 0 0 0 -0.2317 1.7866 -1.5200 H 0 0 0 0 0 2.0898 1.1112 -2.0704 H 0 0 0 0 0 1.9511 1.5827 -0.3604 H 0 0 0 0 0 1.8837 -1.2751 -1.4277 H 0 0 0 0 0 1.9377 -1.8929 0.9725 H 0 0 0 0 0 1.8620 -0.1702 1.4178 H 0 0 0 0 0 -0.3838 -1.2166 1.5240 H 0 0 0 0 0 -0.2452 -1.6892 -0.1861 H 0 0 0 0 0 6.1250 -2.7680 -0.1710 H 0 0 0 0 0 6.0925 -1.3950 -1.3046 H 0 0 0 0 0 3.8818 -2.4766 -1.2428 H 0 0 0 0 0 3.8154 -2.2823 0.5261 H 0 0 0 0 0 -4.1629 -3.9351 2.1886 H 0 0 0 0 0 -4.0473 -5.1018 0.9850 H 0 0 0 0 0 -7.8813 0.1013 -1.1836 H 0 0 0 0 0 -7.5646 -0.6563 0.4061 H 0 0 0 0 0 -1.9598 4.6489 1.1368 H 0 0 0 0 0 5.9149 1.0374 1.4152 H 0 0 0 0 0 5.9670 0.8771 -0.3574 H 0 0 0 0 0 3.6675 1.3810 0.3670 H 0 0 0 0 0 3.6892 -0.0160 1.4718 H 0 0 0 0 0 22 23 2 0 0 0 22 20 1 0 0 0 23 24 1 0 0 0 21 20 1 0 0 0 21 19 1 0 0 0 20 2 2 0 0 0 24 1 2 0 0 0 2 1 1 0 0 0 2 3 1 0 0 0 1 25 1 0 0 0 19 3 2 0 0 0 19 18 1 0 0 0 3 5 1 0 0 0 18 4 1 0 0 0 25 8 1 0 0 0 8 13 1 0 0 0 8 9 1 0 0 0 13 12 1 0 0 0 12 11 1 0 0 0 5 4 1 0 0 0 5 6 1 0 0 0 29 28 1 0 0 0 29 26 1 0 0 0 9 10 1 0 0 0 6 7 1 0 0 0 28 27 1 0 0 0 10 11 1 0 0 0 11 26 1 0 0 0 26 15 1 0 0 0 27 14 1 0 0 0 7 17 1 0 0 0 7 16 2 0 0 0 15 14 1 0 0 0 4 30 1 0 0 0 4 31 1 0 0 0 5 32 1 0 0 0 6 33 1 0 0 0 6 34 1 0 0 0 8 35 1 0 0 0 9 36 1 0 0 0 9 37 1 0 0 0 10 38 1 0 0 0 10 39 1 0 0 0 11 40 1 0 0 0 12 41 1 0 0 0 12 42 1 0 0 0 13 43 1 0 0 0 13 44 1 0 0 0 14 45 1 0 0 0 14 46 1 0 0 0 15 47 1 0 0 0 15 48 1 0 0 0 17 49 1 0 0 0 17 50 1 0 0 0 18 51 1 0 0 0 18 52 1 0 0 0 23 53 1 0 0 0 28 54 1 0 0 0 28 55 1 0 0 0 29 56 1 0 0 0 29 57 1 0 0 0 M END $$$$