PUBCHEM-ZINC00716187 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6700 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -2.8050 0.0400 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 0.2580 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 0.3260 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 1.1070 -1.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3790 1.3010 -2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9740 0.8290 -3.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6540 2.1050 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2240 2.1720 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1120 1.2040 -4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6360 1.2650 -5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2710 2.2940 -6.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3830 3.2620 -5.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8630 3.2040 -4.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -4.6360 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 -0.2180 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 1.2670 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 0.8010 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -0.6830 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 1.4850 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3740 1.6290 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4420 3.1140 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3980 0.4000 -3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3290 0.5090 -5.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6790 2.3420 -7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0980 4.0660 -6.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 3.9620 -4.3730 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 M END