CHEMBRIDGE-ZINC03880423 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -2.4170 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -0.5910 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -1.0390 -2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -1.1510 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -0.8180 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 -0.3720 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -0.2520 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -0.9400 -1.2520 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8820 -1.3340 -2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -0.6480 -0.2600 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.7100 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -1.2990 -3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -1.4990 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -0.1140 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 0.1010 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -1.9970 -0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -2.3710 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 4 26 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END