RDKit 3D 52 56 0 0 0 0 0 0 0 0999 V2000 -6.8479 -0.7519 1.6151 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5133 0.0807 0.3827 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9187 1.5419 0.5566 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0427 -0.0078 0.0107 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.6422 -1.3677 -0.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2882 -1.2685 -1.3019 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2759 -0.5160 -0.4916 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6527 0.2625 0.5902 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3301 1.0234 1.3463 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2479 0.3545 0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8612 -0.4502 -0.7023 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -1.0442 -1.7057 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2643 -1.0110 -1.7117 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8991 -0.3561 -0.5467 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0750 0.5854 0.2028 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 0.2697 -0.9939 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6005 0.8811 -2.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 1.2819 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2761 0.9021 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1995 0.2912 -0.0778 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4803 1.0153 0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6398 1.6188 -0.3509 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7975 1.7311 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8131 1.2416 1.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6697 0.6418 2.2489 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5122 0.5267 1.4765 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 -0.0233 4.0193 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6386 -1.6731 -2.7175 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0495 0.4333 1.0853 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5328 -1.7934 1.5006 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9311 -0.7564 1.7813 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3860 -0.3491 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0598 -0.3182 -0.4805 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4598 1.9945 1.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0049 1.6210 0.6766 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 2.1375 -0.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9057 0.6649 -0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4258 -1.6761 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5959 -2.0758 0.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4282 -0.7484 -2.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9318 -2.2806 -1.5215 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1695 -1.1671 0.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5495 1.0152 0.9925 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0039 1.0156 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5857 1.7888 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6604 2.0106 -1.3647 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6867 2.2005 0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7159 1.3319 2.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6321 0.0523 1.9033 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0605 -2.0007 -3.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2141 -0.1908 1.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2643 1.4815 1.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 12 28 1 0 8 29 1 0 29 4 1 0 11 7 1 0 15 10 1 0 20 16 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 14 42 1 1 15 43 1 0 17 44 1 0 18 45 1 0 22 46 1 0 23 47 1 0 24 48 1 0 26 49 1 0 28 50 1 0 29 51 1 0 29 52 1 0 M CHG 1 4 1 M END