CHEMBRIDGE-ZINC04839730 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.5400 1.1610 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -0.3250 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -1.1180 -0.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -0.8350 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 0.0200 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -0.5020 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -1.8830 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -2.7510 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -2.2210 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -4.0920 -0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -5.0030 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -2.4850 0.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -1.6560 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1940 -2.5980 0.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9650 -3.3370 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4830 -1.8490 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9800 -2.2140 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9920 -3.3230 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4430 -2.8640 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0060 -2.1140 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4360 -0.7070 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1250 -0.6130 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1030 -1.7280 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4610 -3.3450 -0.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 -3.6810 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 1.3530 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 1.6240 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 1.6030 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 1.0990 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 0.2020 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -2.8700 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -4.8510 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -4.9320 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -6.0150 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -1.0700 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 -0.9990 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5350 -1.5310 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 -0.9910 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0550 -1.3960 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9330 -4.1160 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7230 -3.7980 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0630 -3.7530 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5480 -2.2440 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8690 -2.6910 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0890 -2.0230 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1710 -0.0770 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3090 -0.2570 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3490 -0.5670 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6570 0.3490 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1430 -1.3560 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3550 -2.5740 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6080 -2.8130 0.8490 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.3030 -3.3320 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6110 -3.5220 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 39 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END