CHEMSTAR-ZINC03149539 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 0.1170 1.1730 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0050 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6390 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -1.7890 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -2.4320 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9290 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -0.7780 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -0.1380 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.5810 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.8670 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -0.6510 0.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3220 -2.5580 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3670 -3.9650 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5470 -4.6250 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7530 -3.9060 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9840 -4.5720 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1340 -3.8510 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1080 -2.4590 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9330 -1.7790 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7280 -2.4900 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4940 -1.8170 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4490 -0.4630 0.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5750 -6.5160 0.3550 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.5780 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.9150 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 0.9250 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.1800 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -3.3270 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.3860 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 0.7540 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -3.5470 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4500 -4.5270 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0190 -5.6510 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0780 -4.3670 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0340 -1.9100 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9280 -0.6990 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5230 -0.0580 -0.4660 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 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 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 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 37 1 0 0 0 0 M END