CHEMBRIDGE-ZINC01108972 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0760 1.4100 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.0180 -0.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -0.6490 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 0.0950 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -0.5400 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -1.9170 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -2.6760 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -2.0320 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -4.1460 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -4.8010 -0.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -4.8370 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -6.2520 -0.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 -7.0280 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -6.4380 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1830 -7.2260 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0710 -8.6020 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -9.1990 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 -8.4090 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -10.5920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -11.1790 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -10.5030 1.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 -12.6430 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 -13.4210 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -14.7870 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -15.3860 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -14.6200 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -13.2520 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -15.2700 1.2850 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7660 -16.4760 1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -14.5970 1.8090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9350 1.7850 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 1.7590 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.7770 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 1.1740 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 0.0460 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -2.4090 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -2.6110 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -4.5370 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -4.5560 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -5.3620 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1480 -6.7640 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9480 -9.2160 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -8.8700 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 -11.1370 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 -12.9550 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 -15.3910 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -16.4560 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -12.6550 1.3200 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 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END