KEYORGANICS-ZINC01383107 MOE2007 3D Structure written by MMmdl. 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 1.5720 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 2.8880 1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 3.3970 2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 4.5940 2.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 2.4450 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 2.8990 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 1.9860 5.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 0.6290 5.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 0.1610 4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 1.0630 3.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 0.5920 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -0.5990 2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 3.8620 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 4.2750 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 3.8220 -0.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 5.1880 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 5.6890 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 6.5770 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 6.9110 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 5.9940 -1.9340 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 5.1740 -2.6300 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 3.9590 4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 2.3380 6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -0.0730 6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -0.9020 4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 4.6690 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 3.3880 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 7.0040 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 7.5850 -3.9240 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 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 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 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 M END