C1A Converted by convert_cif2sdf.py 2024/03/29 11:09:15 46 46 0 0 0 0 0 0 0 0999 V2000 -1.3521 -1.7152 1.9359 C 0 0 0 0 0 -0.6471 -0.8250 0.9449 C 0 0 0 0 0 0.5880 -0.2882 1.2550 C 0 0 0 0 0 1.2347 0.5286 0.3464 C 0 0 0 0 0 2.5807 1.1152 0.6844 C 0 0 0 0 0 3.8847 -0.0144 0.1373 S 0 0 0 0 0 5.3076 0.8928 0.6432 C 0 0 0 0 0 5.1693 2.0464 1.2337 N 0 0 0 0 0 6.5698 0.3819 0.4137 N 0 0 0 0 0 6.7218 -0.7804 -0.3114 C 0 0 0 0 0 5.6867 -1.3379 -0.8729 N 0 0 0 0 0 7.9657 -1.3508 -0.4433 N 0 0 0 0 0 0.6454 0.8077 -0.8727 C 0 0 0 0 0 1.3503 1.6979 -1.8637 C 0 0 0 0 0 -0.5897 0.2700 -1.1831 C 0 0 0 0 0 -1.2345 -0.5496 -0.2760 C 0 0 0 0 0 -2.5784 -1.1408 -0.6162 C 0 0 0 0 0 -3.8874 -0.0139 -0.0750 S 0 0 0 0 0 -5.3063 -0.9256 -0.5830 C 0 0 0 0 0 -5.1620 -2.0800 -1.1705 N 0 0 0 0 0 -6.5695 -0.4187 -0.3586 N 0 0 0 0 0 -6.7206 0.8516 0.1581 C 0 0 0 0 0 -5.6781 1.6128 0.3316 N 0 0 0 0 0 -7.9721 1.3145 0.4882 N 0 0 0 0 0 2.6959 2.0742 0.1807 H 0 0 0 0 0 2.6541 1.2593 1.7623 H 0 0 0 0 0 5.9477 2.5125 1.5775 H 0 0 0 0 0 7.3492 0.8412 0.7641 H 0 0 0 0 0 5.7932 -2.1561 -1.3829 H 0 0 0 0 0 8.7360 -0.9353 -0.0265 H 0 0 0 0 0 8.0722 -2.1688 -0.9542 H 0 0 0 0 0 1.9803 1.0912 -2.5134 H 0 0 0 0 0 0.6113 2.2274 -2.4666 H 0 0 0 0 0 1.9683 2.4195 -1.3297 H 0 0 0 0 0 -1.0495 0.4879 -2.1364 H 0 0 0 0 0 -2.6478 -1.2880 -1.6938 H 0 0 0 0 0 -2.6927 -2.0992 -0.1103 H 0 0 0 0 0 -5.9422 -2.6164 -1.3852 H 0 0 0 0 0 -7.3508 -0.9554 -0.5631 H 0 0 0 0 0 -5.7846 2.5057 0.6940 H 0 0 0 0 0 -8.7495 0.7482 0.3590 H 0 0 0 0 0 -8.0786 2.2084 0.8508 H 0 0 0 0 0 -1.9820 -1.1085 2.5856 H 0 0 0 0 0 -1.9700 -2.4365 1.4009 H 0 0 0 0 0 -0.6141 -2.2454 2.5376 H 0 0 0 0 0 1.0478 -0.5059 2.2074 H 0 0 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 2 16 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 4 13 2 0 0 0 5 6 1 0 0 0 5 25 1 0 0 0 5 26 1 0 0 0 6 7 1 0 0 0 7 8 2 0 0 0 7 9 1 0 0 0 8 27 1 0 0 0 9 10 1 0 0 0 9 28 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 11 29 1 0 0 0 12 30 1 0 0 0 12 31 1 0 0 0 13 14 1 0 0 0 13 15 1 0 0 0 14 32 1 0 0 0 14 33 1 0 0 0 14 34 1 0 0 0 15 16 2 0 0 0 15 35 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 17 36 1 0 0 0 17 37 1 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 19 21 1 0 0 0 20 38 1 0 0 0 21 22 1 0 0 0 21 39 1 0 0 0 22 23 2 0 0 0 22 24 1 0 0 0 23 40 1 0 0 0 24 41 1 0 0 0 24 42 1 0 0 0 1 43 1 0 0 0 1 44 1 0 0 0 1 45 1 0 0 0 3 46 1 0 0 0 M END $$$$