CHEMBRIDGE-ZINC02880713 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0020 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6350 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1090 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -0.5200 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9190 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.6680 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0250 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.8110 -0.0700 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0420 -4.0280 -0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -2.2410 -0.0810 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.9520 -2.5980 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -3.8100 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2230 -1.7890 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3480 -2.6700 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5780 -2.0990 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7040 -0.7170 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9560 -0.1370 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0950 -0.9260 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9880 -2.3000 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7270 -2.9010 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6060 -4.3710 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -4.8900 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7140 -5.1380 0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.6020 -6.5270 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5280 -7.1920 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4210 -8.5630 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3820 -9.2750 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4530 -8.6160 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5700 -7.2460 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8040 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.7920 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.7730 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1880 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 0.0610 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -3.7480 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -1.1700 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 -1.1520 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8210 -0.0950 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0490 0.9390 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0700 -0.4630 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8780 -2.9110 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5880 -4.7270 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7760 -6.6360 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5850 -9.0800 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2960 -10.3480 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2020 -9.1750 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4090 -6.7330 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END