J47 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 25 26 0 0 0 0 0 0 0 0999 V2000 3.6500 -3.7181 0.8017 N 0 0 0 0 0 3.4853 -2.6220 0.5559 C 0 0 0 0 0 3.2780 -1.2389 0.2462 C 0 0 0 0 0 4.3690 -0.4071 -0.0165 C 0 0 0 0 0 4.1623 0.9239 -0.3134 C 0 0 0 0 0 5.6402 2.0498 -0.6693 BR 0 0 0 0 0 2.8770 1.4393 -0.3541 C 0 0 0 0 0 1.7906 0.6279 -0.0966 C 0 0 0 0 0 1.9787 -0.7136 0.1995 C 0 0 0 0 0 0.9114 -1.5135 0.4474 O 0 0 0 0 0 -0.3314 -0.9864 0.2879 C 0 0 0 0 0 -1.0004 -0.4455 1.3744 C 0 0 0 0 0 -0.9334 -0.9840 -0.9674 C 0 0 0 0 0 -0.2784 -1.5094 -2.0376 O 0 0 0 0 0 -2.2002 -0.4460 -1.1250 C 0 0 0 0 0 -2.8648 0.0870 -0.0349 C 0 0 0 0 0 -4.4523 0.7612 -0.2328 CL 0 0 0 0 0 -2.2649 0.0896 1.2112 C 0 0 0 0 0 5.3731 -0.8046 0.0140 H 0 0 0 0 0 2.7240 2.4831 -0.5871 H 0 0 0 0 0 0.7917 1.0371 -0.1295 H 0 0 0 0 0 -0.5337 -0.4431 2.3484 H 0 0 0 0 0 -0.4454 -2.4518 -2.1776 H 0 0 0 0 0 -2.6676 -0.4432 -2.0980 H 0 0 0 0 0 -2.7847 0.5113 2.0593 H 0 0 0 0 0 6 5 1 0 0 0 4 5 2 0 0 0 4 3 1 0 0 0 5 7 1 0 0 0 1 2 3 0 0 0 2 3 1 0 0 0 3 9 2 0 0 0 7 8 2 0 0 0 9 8 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 11 13 1 0 0 0 12 18 1 0 0 0 14 13 1 0 0 0 13 15 2 0 0 0 18 16 2 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 4 19 1 0 0 0 7 20 1 0 0 0 8 21 1 0 0 0 12 22 1 0 0 0 14 23 1 0 0 0 15 24 1 0 0 0 18 25 1 0 0 0 M END $$$$