CHEMDIV-ZINC04733842 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 3.9680 5.5920 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 4.5560 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 4.9640 -3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 4.0450 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 2.7040 -3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 2.2830 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 3.1920 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 2.7600 -2.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 1.6760 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 0.7850 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 0.1780 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 1.2950 -0.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 1.9370 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 1.3590 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 0.0990 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -0.4790 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4060 2.1510 1.9950 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 0.7700 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -0.3730 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -0.0940 -3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 1.2450 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 2.1530 -2.9390 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 1.9250 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 5.5480 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 6.6060 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 5.4300 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 6.0100 -3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2450 4.3760 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 1.9830 -3.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 1.2250 -2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 3.3290 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 2.8810 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -0.3520 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -1.4040 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -1.3670 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -0.8430 -3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 2.6810 -3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 2.4120 -5.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 1.2060 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -0.1520 -0.3860 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9140 -0.9300 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 18 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 40 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END