CHEMBRIDGE-ZINC03000714 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 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 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -4.0270 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -4.4470 2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -4.1370 3.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -4.4480 4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -4.1750 6.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -4.4920 7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -5.0810 7.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -5.3540 6.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -5.0450 5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -6.1580 6.5820 Br 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 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -2.5820 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.4290 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -4.3430 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -4.4970 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -5.5190 2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -3.9090 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -3.7150 5.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -4.2800 8.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -5.3280 8.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -5.2620 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.5670 1.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -2.1080 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 29 1 0 0 0 0 30 31 1 0 0 0 0 M END