CQP Converted by convert_cif2sdf.py 2024/03/29 11:09:15 51 54 0 0 0 0 0 0 0 0999 V2000 10.0392 0.9678 0.2463 CL 0 0 0 0 0 8.3730 0.6720 -0.1437 C 0 0 0 0 0 7.7688 -0.5074 0.2535 C 0 0 0 0 0 6.4430 -0.7428 -0.0574 C 0 0 0 0 0 5.7205 0.2008 -0.7642 C 0 0 0 0 0 4.2745 -0.0559 -1.1024 C 0 0 0 0 0 3.4432 0.4435 -0.0529 O 0 0 0 0 0 2.0929 0.1707 -0.4311 C 0 0 0 0 0 1.6342 -1.1820 0.1539 C 0 0 0 0 0 0.2132 -0.9658 0.5292 N 0 0 0 0 0 0.1898 0.4079 1.0935 C 0 0 0 0 0 -1.2260 0.9857 1.0344 C 0 0 0 0 0 -2.1481 0.0909 1.7384 N 0 0 0 0 0 -3.6540 0.6275 2.1696 S 0 0 0 0 0 -3.4518 1.8914 2.7857 O 0 0 0 0 0 -4.3032 -0.4859 2.7698 O 0 0 0 0 0 -4.5420 0.9551 0.6830 C 0 0 0 0 0 -4.9425 2.2237 0.3892 C 0 0 0 0 0 -5.6453 2.5010 -0.7817 C 0 0 0 0 0 -5.9530 1.5133 -1.6678 C 0 0 0 0 0 -5.5566 0.1939 -1.3985 C 0 0 0 0 0 -5.8470 -0.8656 -2.2735 C 0 0 0 0 0 -5.4559 -2.0823 -1.9778 N 0 0 0 0 0 -4.7853 -2.3723 -0.8713 C 0 0 0 0 0 -4.4560 -1.4180 0.0415 C 0 0 0 0 0 -4.8362 -0.0859 -0.2076 C 0 0 0 0 0 6.3237 1.3799 -1.1601 C 0 0 0 0 0 1.1424 1.2190 0.1854 C 0 0 0 0 0 7.6485 1.6186 -0.8453 C 0 0 0 0 0 8.3336 -1.2449 0.8054 H 0 0 0 0 0 5.9704 -1.6635 0.2527 H 0 0 0 0 0 4.0243 0.4489 -2.0360 H 0 0 0 0 0 4.1132 -1.1279 -1.2152 H 0 0 0 0 0 1.9976 0.1660 -1.5171 H 0 0 0 0 0 1.7134 -1.9672 -0.5971 H 0 0 0 0 0 2.2252 -1.4355 1.0336 H 0 0 0 0 0 0.0155 -1.5959 1.2917 H 0 0 0 0 0 0.5551 0.4044 2.1207 H 0 0 0 0 0 -1.2384 1.9666 1.5084 H 0 0 0 0 0 -1.5363 1.0809 -0.0069 H 0 0 0 0 0 -1.8759 -0.8150 1.9529 H 0 0 0 0 0 -4.7116 3.0264 1.0729 H 0 0 0 0 0 -5.9505 3.5157 -0.9907 H 0 0 0 0 0 -6.4999 1.7430 -2.5710 H 0 0 0 0 0 -6.3909 -0.6782 -3.1876 H 0 0 0 0 0 -4.4925 -3.3960 -0.6882 H 0 0 0 0 0 -3.9096 -1.6757 0.9368 H 0 0 0 0 0 5.7590 2.1159 -1.7123 H 0 0 0 0 0 1.7066 1.9399 0.7756 H 0 0 0 0 0 0.5785 1.7279 -0.5971 H 0 0 0 0 0 8.1201 2.5398 -1.1546 H 0 0 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 2 29 1 0 0 0 3 4 1 0 0 0 3 30 1 0 0 0 4 5 2 0 0 0 4 31 1 0 0 0 5 6 1 0 0 0 5 27 1 0 0 0 6 7 1 0 0 0 6 32 1 0 0 0 6 33 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 8 28 1 0 0 0 8 34 1 0 0 0 9 10 1 0 0 0 9 35 1 0 0 0 9 36 1 0 0 0 10 11 1 0 0 0 10 37 1 0 0 0 11 12 1 0 0 0 11 28 1 0 0 0 11 38 1 0 0 0 12 13 1 0 0 0 12 39 1 0 0 0 12 40 1 0 0 0 13 14 1 0 0 0 13 41 1 0 0 0 14 15 2 0 0 0 14 16 2 0 0 0 14 17 1 0 0 0 17 18 2 0 0 0 17 26 1 0 0 0 18 19 1 0 0 0 18 42 1 0 0 0 19 20 2 0 0 0 19 43 1 0 0 0 20 21 1 0 0 0 20 44 1 0 0 0 21 22 2 0 0 0 21 26 1 0 0 0 22 23 1 0 0 0 22 45 1 0 0 0 23 24 2 0 0 0 24 25 1 0 0 0 24 46 1 0 0 0 25 26 2 0 0 0 25 47 1 0 0 0 27 29 2 0 0 0 27 48 1 0 0 0 28 49 1 0 0 0 28 50 1 0 0 0 29 51 1 0 0 0 M END $$$$