CHEMDIV-ZINC04733925 MOE2007 3D Structure written by MMmdl. 38 41 0 0 0 0 0 0 0 0999 V2000 -4.1860 1.0690 4.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 1.0400 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 0.2700 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 0.2170 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 0.9220 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 1.6830 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 1.7350 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 0.8830 0.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 1.7760 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 1.5930 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 3.7430 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 3.1700 0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 3.8990 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 5.2440 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 5.9040 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 5.1700 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 6.3100 0.1340 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 0.3500 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 0.1750 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 -1.1030 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 -2.0720 0.1850 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -0.7840 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 0.2630 4.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 2.0270 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 0.9490 3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -0.2940 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -0.3770 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 2.2310 2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 2.3220 4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.0330 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 3.3710 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 6.9890 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 5.6200 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 0.9240 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 -1.5190 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -0.9420 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 2.8350 -0.1830 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0940 3.0170 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 37 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 31 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 32 1 0 0 0 0 16 33 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 36 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 37 1 M END