CHEMBRIDGE-ZINC04059577 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 2.1380 1.4000 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 0.0180 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6820 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 0.0070 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 1.3910 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0900 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.4900 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 4.1660 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 5.5540 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 6.1850 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 5.4440 -0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 4.1310 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 3.4960 -0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 7.5660 -0.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 6.3390 -0.1870 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7300 6.5880 -1.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 6.7350 0.8610 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5370 -0.9010 -1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -2.1540 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -2.0230 -0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9440 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -0.5160 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 1.9280 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 3.9860 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 3.5590 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 8.0990 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 7.9980 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -2.2910 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -2.9820 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 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 15 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END