RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 -5.4816 2.4466 1.3667 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1988 1.4337 0.7705 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8523 0.2254 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7713 -0.4732 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4452 -1.6996 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1231 -1.6684 -1.0963 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0637 -0.7599 -2.1212 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9518 -1.4428 -0.1725 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3294 -1.6763 -0.9079 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0481 -0.3423 -0.8568 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3610 -0.4885 -0.5115 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5719 -0.0002 0.7490 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0122 1.4468 0.6751 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2753 2.1738 2.4655 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.3729 1.5564 -0.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2623 1.0134 -1.4195 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2263 -0.0481 1.4418 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3273 0.3329 0.2850 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9274 -0.1950 0.3749 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7229 3.3426 1.9063 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 -0.1112 -0.7098 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1256 -0.1218 1.1411 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2564 -1.9212 -1.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4194 -2.5993 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0182 -2.6862 -1.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4918 0.0123 -1.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0608 -2.1793 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -1.9879 -1.9472 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9378 -2.4956 -0.4423 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8994 0.2099 -1.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3466 -0.5599 1.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2653 2.0891 0.1829 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7514 2.5791 -0.0037 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0607 0.9262 0.5917 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 1.5066 -2.0558 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2691 1.2497 -1.8254 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -0.0780 -1.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0092 -1.0931 1.7184 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1546 0.6571 2.2841 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3383 1.4262 0.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 16 15 1 0 15 13 1 0 13 14 1 0 13 12 1 0 12 17 1 0 17 18 1 0 18 19 1 0 19 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 8 6 1 0 6 7 1 0 6 5 1 0 5 4 1 0 4 3 2 0 3 2 1 0 2 1 3 0 11 12 1 0 10 18 1 0 16 35 1 0 16 36 1 0 16 37 1 0 15 33 1 0 15 34 1 0 13 32 1 6 12 31 1 1 17 38 1 0 17 39 1 0 18 40 1 6 8 27 1 1 9 28 1 0 9 29 1 0 10 30 1 6 6 25 1 6 7 26 1 0 5 23 1 0 5 24 1 0 4 22 1 0 3 21 1 0 1 20 1 0 M END