CHEMBRIDGE-ZINC04950453 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5700 -1.6950 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -0.8500 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 -0.2950 1.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -1.5960 2.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -1.7290 3.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -2.4490 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -2.5840 5.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -3.3300 6.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -3.4700 8.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -4.2430 8.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -4.3690 10.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -3.7330 10.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -2.9670 9.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -2.8360 8.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -3.8730 12.0130 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4860 -4.5460 12.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -3.3150 12.3460 O 0 5 0 0 0 0 0 0 0 0 0 0 4.6580 0.0270 -0.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -2.0400 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -2.9440 4.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -2.0900 6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -3.8250 6.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -4.7390 8.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -4.9650 10.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2150 -2.4740 10.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -2.2420 7.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 0.9180 -0.4830 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 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 31 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 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 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END