RDKit 3D 39 39 0 0 0 0 0 0 0 0999 V2000 4.8468 0.3175 1.3723 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4649 0.3616 -0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5411 0.2097 -1.1041 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1819 0.5342 -0.4477 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1838 0.6759 0.6045 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1831 -0.4259 0.6078 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3591 -0.6197 -0.5606 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9559 -1.0467 -1.8867 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9507 -0.4710 -0.5273 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6821 -0.1037 0.6505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1713 0.1250 1.7569 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1466 0.0330 0.6286 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8736 -0.1934 -0.5455 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2468 -0.0792 -0.6175 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9107 -0.3137 -1.7995 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9617 0.2703 0.4938 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8833 0.4377 0.4239 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.2924 0.4979 1.6507 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8809 0.3839 1.7382 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3289 0.6354 2.9445 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6395 1.2763 1.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -0.4816 1.9053 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9117 0.0631 1.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3317 -0.4179 -0.6511 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 -0.2942 -1.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8884 1.2313 -1.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0092 0.5689 -1.5082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6444 0.6886 1.6364 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7379 1.6884 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9143 -1.3628 0.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7657 -0.6581 1.5987 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9309 -1.4984 -1.6491 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3498 -1.8783 -2.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0979 -0.2249 -2.5795 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4752 -0.6465 -1.4766 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -0.4710 -1.4247 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8946 -0.2324 -1.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8592 0.7769 2.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4498 0.6439 3.3136 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 2 0 16 17 1 0 16 18 1 0 18 19 2 0 19 20 1 0 19 12 1 0 1 21 1 0 1 22 1 0 1 23 1 0 3 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 8 32 1 0 8 33 1 0 8 34 1 0 9 35 1 0 13 36 1 0 15 37 1 0 18 38 1 0 20 39 1 0 M END