RDKit 3D 53 56 0 0 0 0 0 0 0 0999 V2000 7.7845 1.8482 0.9575 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4533 1.5590 1.3611 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5783 1.1948 0.3726 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9136 0.9242 -0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9227 0.5498 -1.8654 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5927 0.4435 -1.4553 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2397 0.7294 -0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2448 1.0865 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8506 0.5799 0.3773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6791 0.3060 1.5691 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6734 0.6665 -0.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4586 1.5352 -1.5287 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9648 1.2235 -1.9687 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6353 1.7994 -2.8144 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4235 0.1523 -1.2159 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4672 -0.2423 -0.2146 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1267 -1.7228 -0.3112 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1816 -2.3267 -1.5437 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5032 -3.6830 -1.6153 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5269 -4.4552 -0.4553 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2354 -3.8639 0.7726 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0859 -2.5088 0.8516 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2775 -4.9113 2.3472 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -0.2491 -1.1954 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6403 0.5705 -0.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1189 0.2339 -0.3538 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9419 0.8948 0.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3282 0.3764 1.8422 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1350 1.3413 2.3984 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2538 2.4205 1.5612 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5145 2.1280 0.5134 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 2.4702 -2.0608 O 0 0 0 0 0 1 0 0 0 0 0 0 8.2875 0.9484 0.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3326 2.1963 1.8385 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 2.6503 0.2122 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9329 0.9971 -1.3157 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1773 0.3528 -2.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 0.1621 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 1.2927 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8926 -0.0010 0.7674 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1765 -1.7289 -2.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7411 -4.1302 -2.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7824 -5.5087 -0.5177 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -2.0504 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2153 -0.1167 -2.2064 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8692 -1.3169 -0.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4857 1.6434 -0.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3032 0.3708 0.8159 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4928 0.5286 -1.3414 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2859 -0.8446 -0.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0083 -0.5941 2.1932 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6382 1.3155 3.3557 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3626 2.7627 -0.3506 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 21 23 1 0 15 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 12 32 1 0 8 3 1 0 16 11 1 0 22 17 1 0 31 27 1 0 1 33 1 0 1 34 1 0 1 35 1 0 4 36 1 0 5 37 1 0 6 38 1 0 8 39 1 0 16 40 1 1 18 41 1 0 19 42 1 0 20 43 1 0 22 44 1 0 24 45 1 0 24 46 1 0 25 47 1 0 25 48 1 0 26 49 1 0 26 50 1 0 28 51 1 0 29 52 1 0 31 53 1 0 M CHG 1 32 -1 M END