IBS-ZINC02424310 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 0.3990 1.3780 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -0.1110 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -0.8900 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -0.3560 0.5680 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1560 0.3000 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -1.8020 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -2.6730 0.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -1.9790 -0.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -3.3100 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -0.1160 1.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -0.9090 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 1.0900 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 2.0980 0.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 1.0510 2.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 2.1870 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 3.3130 3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 5.7490 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 6.9790 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7690 6.7330 4.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 5.6620 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6870 4.3570 3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 1.5360 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 1.9550 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 1.7860 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -0.4580 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -0.5720 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -1.9660 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -0.7320 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.0110 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -3.5980 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -3.3320 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3230 0.1990 2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 2.5660 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 1.7980 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 2.9960 4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 3.6260 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 5.9130 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 5.4690 4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 7.8200 4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 7.2820 2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 5.5400 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 5.9360 2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4870 4.0580 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2150 3.5620 3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 4.5540 3.1720 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4890 4.7870 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 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 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 45 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 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END