IBS-ZINC02231010 MOE2007 3D Structure written by MMmdl. 43 46 0 0 0 0 0 0 0 0999 V2000 4.4520 2.8720 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 3.4250 0.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 2.6120 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 1.3050 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 0.4780 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 0.9460 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 2.2620 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 3.0900 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 2.7250 0.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 1.9880 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 0.6570 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 0.0710 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -1.0800 -0.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7340 -0.0910 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -1.2490 -0.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 0.5160 -0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 1.8110 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 2.5140 0.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 2.4490 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2340 2.4620 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4540 3.0560 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7060 3.6470 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7380 3.6420 1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5150 3.0480 1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3800 4.4650 1.2790 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 -0.2190 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6280 -0.7920 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8050 -0.4740 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 2.0110 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 2.5600 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 3.6250 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 0.9440 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -0.5350 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 4.1060 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0370 2.0060 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2130 3.0630 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9410 4.1050 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 3.0450 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 0.4580 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -1.0290 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -1.4630 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4820 0.1280 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0980 -0.8150 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 M END