CHEMBRIDGE-ZINC01122676 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -1.7340 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.4150 -0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -2.2560 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -3.9120 -1.2040 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -4.2670 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -5.4630 -1.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -6.1080 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6010 -5.7530 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0320 -6.8220 -1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4630 -4.8050 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9310 -3.6020 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 -3.3740 -0.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8130 -2.5780 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 -1.3690 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1050 -0.4180 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4610 -0.6620 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9970 -1.8590 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1820 -2.8150 0.3200 C 0 0 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.0330 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -2.3030 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -1.5890 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5200 -5.0060 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -1.1780 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 0.5180 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1040 0.0840 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0570 -2.0440 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6020 -3.7480 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END