CHEMBRIDGE-ZINC00237465 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.6740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.0570 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4420 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0990 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 2.2160 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6140 3.4340 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 1.6360 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5030 -0.9490 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 -0.7090 -0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -2.1750 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -2.1000 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -3.0440 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -3.3740 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -4.6000 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 -5.7570 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -5.6580 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -4.4800 -0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -3.3560 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5590 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -4.6480 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -6.7260 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 -6.5560 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -2.4100 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 15 1 0 0 0 0 13 14 2 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 24 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 27 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END