JBA Converted by convert_cif2sdf.py 2024/03/01 05:07:52 50 52 0 0 0 0 0 0 0 0999 V2000 -5.2401 1.2049 2.9246 O 0 0 0 0 0 -5.9775 1.0684 1.7166 S 0 0 0 0 0 -7.3089 0.5776 1.7696 O 0 0 0 0 0 -5.9845 2.6681 0.8602 C 0 0 0 0 0 -5.0240 0.0347 0.5716 C 0 0 0 0 0 -4.8833 -1.3739 1.1524 C 0 0 0 0 0 -5.7390 -0.0383 -0.7529 C 0 0 0 0 0 -7.0305 -0.4207 -0.8017 N 0 0 0 0 0 -7.7027 -0.4883 -2.0459 O 0 0 0 0 0 -5.1521 0.2471 -1.7758 O 0 0 0 0 0 -3.6354 0.6432 0.3683 C 0 0 0 0 0 -2.7860 -0.2979 -0.4886 C 0 0 0 0 0 -2.5223 -1.5399 0.2251 O 0 0 0 0 0 -1.2030 -1.6830 0.3988 C 0 0 0 0 0 -0.7084 -2.6354 0.9671 O 0 0 0 0 0 -0.4774 -0.6780 -0.1109 N 0 0 0 0 0 -1.3863 0.3022 -0.7239 C 0 0 0 0 0 0.9168 -0.5788 -0.0676 C 0 0 0 0 0 1.6723 -1.6358 0.4243 C 0 0 0 0 0 3.0463 -1.5411 0.4679 C 0 0 0 0 0 3.6790 -0.3812 0.0184 C 0 0 0 0 0 2.9176 0.6794 -0.4745 C 0 0 0 0 0 1.5433 0.5765 -0.5207 C 0 0 0 0 0 5.1073 -0.2791 0.0627 C 0 0 0 0 0 6.2778 -0.1946 0.0994 C 0 0 0 0 0 7.7452 -0.0903 0.1455 C 0 0 0 0 0 8.3764 1.2078 -0.3623 C 0 0 0 0 0 8.3516 0.9050 1.1374 C 0 0 0 0 0 -4.9587 3.0121 0.7251 H 0 0 0 0 0 -6.4616 2.5557 -0.1129 H 0 0 0 0 0 -6.5364 3.3960 1.4542 H 0 0 0 0 0 -5.8659 -1.7478 1.4418 H 0 0 0 0 0 -4.4497 -2.0349 0.4025 H 0 0 0 0 0 -4.2351 -1.3424 2.0281 H 0 0 0 0 0 -7.4998 -0.6485 0.0162 H 0 0 0 0 0 -8.6253 -0.7721 -1.9804 H 0 0 0 0 0 -3.7312 1.6058 -0.1333 H 0 0 0 0 0 -3.1557 0.7842 1.3371 H 0 0 0 0 0 -3.2819 -0.4995 -1.4375 H 0 0 0 0 0 -1.1854 0.3967 -1.7909 H 0 0 0 0 0 -1.2965 1.2693 -0.2291 H 0 0 0 0 0 1.1825 -2.5329 0.7722 H 0 0 0 0 0 3.6337 -2.3632 0.8501 H 0 0 0 0 0 3.4035 1.5786 -0.8233 H 0 0 0 0 0 0.9538 1.3947 -0.9059 H 0 0 0 0 0 8.2879 -1.0180 -0.0335 H 0 0 0 0 0 9.3360 1.1336 -0.8751 H 0 0 0 0 0 7.7050 1.9836 -0.7312 H 0 0 0 0 0 7.6632 1.4816 1.7552 H 0 0 0 0 0 9.2942 0.6316 1.6113 H 0 0 0 0 0 9 8 1 0 0 0 8 7 1 0 0 0 10 7 2 0 0 0 7 5 1 0 0 0 3 2 2 0 0 0 4 2 1 0 0 0 5 2 1 0 0 0 5 6 1 0 0 0 5 11 1 0 0 0 2 1 2 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 12 17 1 0 0 0 13 14 1 0 0 0 17 16 1 0 0 0 14 16 1 0 0 0 14 15 2 0 0 0 16 18 1 0 0 0 19 18 2 0 0 0 19 20 1 0 0 0 18 23 1 0 0 0 20 21 2 0 0 0 23 22 2 0 0 0 21 22 1 0 0 0 21 24 1 0 0 0 24 25 3 0 0 0 25 26 1 0 0 0 28 26 1 0 0 0 28 27 1 0 0 0 26 27 1 0 0 0 4 29 1 0 0 0 4 30 1 0 0 0 4 31 1 0 0 0 6 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 11 37 1 0 0 0 11 38 1 0 0 0 12 39 1 0 0 0 17 40 1 0 0 0 17 41 1 0 0 0 19 42 1 0 0 0 20 43 1 0 0 0 22 44 1 0 0 0 23 45 1 0 0 0 26 46 1 0 0 0 27 47 1 0 0 0 27 48 1 0 0 0 28 49 1 0 0 0 28 50 1 0 0 0 M END $$$$