IBS-ZINC05215467 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 0 0 0 0 0 0999 V2000 -2.0930 2.1320 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 0.7540 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 0.5120 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -0.7100 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -1.7190 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -1.5100 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -0.2820 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -0.1290 -2.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -0.8610 -3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -0.3300 -4.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.9090 -5.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -1.9610 -5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -2.1060 -4.3200 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -2.7910 -6.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -2.2880 -7.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -4.1770 -6.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -5.0490 -7.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -5.9660 -8.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -5.8010 -6.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -4.8640 -5.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -7.8490 -7.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -8.7760 -6.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -8.5530 -6.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -8.2330 -7.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -7.3150 -8.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 0.7340 -3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 0.8740 -2.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.6580 -4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 2.0990 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 2.5780 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 2.8150 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 1.2910 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -0.8710 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -2.6790 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -2.3570 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -0.6070 -6.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -5.6490 -7.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -4.4710 -8.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -6.6900 -9.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -5.3940 -8.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -5.2220 -6.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -6.3960 -5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -4.1520 -4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -5.4360 -5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -8.4360 -8.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -8.6250 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -9.8160 -6.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -7.7000 -5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -9.4280 -6.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -7.7580 -7.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -9.1490 -8.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -7.3460 -9.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -6.2830 -8.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 2.2970 -4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 2.3040 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 1.0980 -4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -6.7560 -7.2290 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1660 -7.2550 -6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 57 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 45 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END