IBS-ZINC04039295 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.8430 0.1460 4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -0.8270 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -1.1100 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.1740 1.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -2.8980 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -3.8840 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -4.1730 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -3.4790 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -2.4310 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -1.6170 2.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -0.4870 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 0.9790 3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.8300 2.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3040 1.7440 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 3.1570 2.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 3.1120 3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 4.0340 4.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 1.6850 4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 1.2500 5.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 4.3920 2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 4.8010 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 6.3400 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 6.6990 2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 1.5620 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 0.9020 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 0.6300 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 1.0330 -1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 1.6710 -0.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 1.9110 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -1.1150 3.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 1.1330 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -0.1710 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 0.2330 5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -2.6340 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -4.4750 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -4.9750 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -3.7020 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 5.1760 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 4.2630 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 4.1170 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 4.8010 3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 5.6440 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 6.1220 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 7.3730 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 6.6640 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 6.0570 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 7.7330 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 0.5860 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.1140 -2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 0.8450 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 2.4110 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 2.0490 5.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 6.2020 1.9040 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3730 6.8270 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 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 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 30 2 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 15 20 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 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 53 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 53 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END