CHEMBRIDGE-ZINC00317513 MOE2007 3D Structure written by MMmdl. 20 21 0 0 0 0 0 0 0 0999 V2000 -2.6060 4.7960 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 4.7470 -1.2520 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 3.3610 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 3.4030 -0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 4.2540 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 2.1200 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 1.6370 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 0.2460 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -0.6040 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.0990 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 1.2800 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -0.5170 1.3880 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 3.8660 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 4.9350 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 5.6300 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 2.3030 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -1.6790 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -0.7370 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 2.1050 -1.1530 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6810 1.8180 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 19 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 19 1 M END