RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 2.9736 0.1764 1.9082 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5993 1.4265 2.1136 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5087 2.1321 0.9391 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8601 1.3715 0.0058 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5131 0.1946 0.6059 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7563 -0.7959 -0.2439 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4645 -0.8948 -1.6494 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9539 -0.9982 -1.5707 N 0 0 0 0 0 4 0 0 0 0 0 0 0.3053 -0.4227 -0.3288 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -1.3569 -1.1389 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9766 -0.8813 -1.3449 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3455 0.1989 -0.3375 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.8661 -0.1948 1.0391 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3166 -0.2984 1.0262 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7733 0.6166 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7899 0.3212 0.5583 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2872 1.7267 0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 3.8774 0.5854 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.3837 1.9298 3.7375 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.8586 -0.6238 2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8409 -1.7825 0.2331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1311 -1.7836 -2.1932 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 -0.0079 -2.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3734 -1.0868 -2.5079 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3582 -0.1395 -1.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2883 -1.7948 -1.0122 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0785 -1.4889 -2.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5168 -2.3490 -0.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0959 -0.4294 -2.3356 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6813 -1.7108 -1.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7744 1.0192 -0.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1819 0.5676 1.7561 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3258 -1.1591 1.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.6150 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0292 -1.1410 1.6681 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1366 0.6406 -1.5322 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5278 -0.1883 1.4759 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8083 0.1099 0.2412 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6697 2.1589 1.1443 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9742 2.4451 -0.0728 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 12 15 1 0 15 16 1 0 16 17 1 0 3 18 1 0 2 19 1 0 5 1 2 0 14 9 1 0 17 15 1 0 1 20 1 0 6 21 1 1 7 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 8 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 13 32 1 0 13 33 1 0 14 34 1 0 14 35 1 0 15 36 1 0 16 37 1 0 16 38 1 0 17 39 1 0 17 40 1 0 M CHG 2 8 1 12 1 M END