RDKit 3D 31 31 0 0 0 0 0 0 0 0999 V2000 2.5699 0.3029 1.2424 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7511 0.5527 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4621 1.6372 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 0.8668 0.2862 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -0.2917 0.1567 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7654 -0.0328 -0.0198 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4508 -1.3686 -0.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9569 0.7209 -1.1607 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3206 0.6182 1.1943 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 1.1297 1.2533 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2058 1.9598 2.8563 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.2812 -0.8974 -1.1035 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7583 -0.7194 -0.8149 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1460 -1.7995 -0.0207 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4722 1.1508 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -0.6488 1.6975 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6257 0.1794 0.9409 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8668 1.9612 -1.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4131 1.2122 -1.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 2.5335 -0.1742 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0913 -1.0132 0.9763 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5484 -1.2823 -0.2208 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0645 -1.7907 -1.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0647 -2.0602 0.5579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7063 0.4071 -1.7199 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7218 0.6968 2.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1508 1.0545 0.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.2933 -1.9659 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0291 -1.9473 -1.1538 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3429 -0.6384 -1.7451 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -2.2004 -0.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 7 6 1 0 6 8 1 6 6 9 1 0 9 10 2 0 10 11 1 0 6 5 1 0 5 12 1 0 12 13 1 0 13 14 1 0 13 2 1 0 2 1 1 0 2 3 1 0 2 4 1 0 4 5 1 0 7 22 1 0 7 23 1 0 7 24 1 0 8 25 1 0 9 26 1 0 10 27 1 0 5 21 1 1 12 28 1 0 12 29 1 0 13 30 1 6 14 31 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 3 19 1 0 3 20 1 0 M END