CHEMBRIDGE-ZINC01125625 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.9820 -1.9230 -3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.4540 -4.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 0.3120 -3.9300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8400 -0.1730 -4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 1.7510 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 0.3200 -2.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 0.5020 -2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 0.5920 -3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0450 0.7760 -3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 0.8730 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 0.7820 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 0.5920 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9430 1.0720 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7280 1.1510 -2.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3860 1.1650 -0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6980 1.3460 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8040 1.4580 -1.3320 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.1410 1.4400 1.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.5130 1.5320 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2990 2.4180 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6550 2.5120 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2380 1.7280 1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4570 0.8340 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0890 0.7340 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2400 -0.2320 3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0780 -0.0070 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3830 -0.7040 4.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -2.4690 -3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -1.9930 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -2.3540 -4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.0230 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.3840 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 1.7450 -5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 2.2970 -4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 2.2360 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 0.5170 -4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7410 0.8460 -3.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 0.8570 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 0.5170 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7590 1.1020 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5080 1.4440 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8490 3.0350 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2610 3.2030 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2980 1.8050 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9530 0.2240 4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8090 -1.1420 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3460 -0.4770 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4150 0.0000 3.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.7760 -0.5670 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 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 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 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 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 48 49 1 0 0 0 0 M END