CHEMBRIDGE-ZINC04804861 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 2.2200 1.4140 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 0.0330 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -0.6800 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.0020 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 1.3790 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0860 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 2.1020 -1.2530 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8920 1.4800 -1.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 3.3200 -1.2530 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2370 -2.0790 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.7720 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -2.1840 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -4.2340 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -5.0100 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -6.3150 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -6.6610 0.4030 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -5.0110 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -4.5210 0.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -5.3720 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -6.5660 0.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 -4.8400 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 -5.9370 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -6.0060 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -4.5500 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 1.9690 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -0.4920 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -0.5540 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1660 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -2.5500 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -4.5720 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -7.0630 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -3.5660 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -4.0190 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -6.8460 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7540 -5.5820 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1110 -6.7100 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8320 -6.1270 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 -3.8160 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 -4.3400 -1.6370 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END