CHEMBRIDGE-ZINC04988698 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 1.0140 -0.5980 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.0310 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -0.4670 -0.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8200 0.0000 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -1.9980 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -2.4720 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -1.9380 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -0.4240 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 1.5340 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 2.0130 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 1.6880 3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 2.1080 5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 2.8610 5.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 3.2020 3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7440 2.7790 2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 3.2940 6.3820 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7060 2.9750 7.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 3.9470 6.3290 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0030 -0.1280 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -1.6760 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -0.4070 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.3100 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 1.0580 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -2.3690 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.4610 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -2.1360 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -3.5680 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -2.2460 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 -2.3740 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 0.0530 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -0.0830 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 2.0130 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 1.8080 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 1.1110 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 1.8420 6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 3.7910 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 3.0510 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 0.0250 1.1780 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6200 -0.4170 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 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 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 38 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 38 1 M END