RDKit 3D 70 72 0 0 0 0 0 0 0 0999 V2000 -4.0433 -0.1928 1.6046 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4995 -0.0304 0.1801 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9647 -0.0738 0.1418 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2794 1.1811 0.6803 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9386 2.0976 1.1718 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1138 1.2282 0.5964 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9339 0.1475 0.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4843 0.5585 -1.2871 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8116 1.0242 -2.4067 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7611 1.2827 -3.4181 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 0.9650 -2.9046 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8256 0.5053 -1.6193 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9344 0.0817 -0.7641 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9674 -1.4143 -0.5537 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9863 -2.3004 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0399 -3.6809 -1.4383 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0849 -4.1861 -0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0792 -3.3234 0.9516 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0276 -1.9426 0.7458 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1602 -6.0538 0.1365 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.8415 2.4091 1.1042 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7643 2.5341 2.6386 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0629 3.9487 3.1424 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9986 4.7043 2.2075 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4001 4.8662 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4636 3.7227 0.4046 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1755 -0.9887 -0.8356 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8664 -2.5160 -0.8914 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0005 -3.2102 0.4688 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4722 -2.8118 -1.4717 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9008 -3.1518 -1.8506 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1338 -0.2877 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -1.0611 2.1162 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 0.6817 2.2175 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8114 0.9745 -0.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6492 -0.1809 -0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6116 -0.9282 0.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7114 -0.0670 0.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3706 -0.7789 -0.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 1.1780 -2.4782 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5656 1.6656 -4.4114 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9792 1.0232 -3.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8728 0.4077 -1.2284 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8336 0.6288 0.1802 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -1.9231 -2.6637 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0507 -4.3492 -2.2959 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1205 -3.7151 1.9649 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0321 -1.2837 1.6127 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9025 2.2418 0.8682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2111 2.2252 3.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4858 1.8316 3.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1227 4.5056 3.2359 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 3.8949 4.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2344 5.6908 2.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9498 4.1627 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8437 5.8097 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2163 4.9521 0.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5616 4.0129 0.6597 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4851 3.6034 -0.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2604 -0.8687 -0.7017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9732 -0.5798 -1.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9629 -4.3004 0.3597 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1837 -2.9376 1.1431 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9514 -2.9622 0.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6701 -2.5716 -0.7701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -3.8773 -1.7096 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -2.2498 -2.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7392 -4.2310 -1.9533 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9234 -3.0067 -1.4856 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8351 -2.7100 -2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 17 20 1 0 6 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 2 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 28 31 1 0 12 8 1 0 19 14 1 0 26 21 1 0 1 32 1 0 1 33 1 0 1 34 1 0 2 35 1 6 3 36 1 0 3 37 1 0 7 38 1 0 7 39 1 0 9 40 1 0 10 41 1 0 11 42 1 0 13 43 1 0 13 44 1 0 15 45 1 0 16 46 1 0 18 47 1 0 19 48 1 0 21 49 1 0 22 50 1 0 22 51 1 0 23 52 1 0 23 53 1 0 24 54 1 0 24 55 1 0 25 56 1 0 25 57 1 0 26 58 1 0 26 59 1 0 27 60 1 0 27 61 1 0 29 62 1 0 29 63 1 0 29 64 1 0 30 65 1 0 30 66 1 0 30 67 1 0 31 68 1 0 31 69 1 0 31 70 1 0 M END