IBS-ZINC01782180 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.5640 0.4370 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -1.0560 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -1.3440 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -1.6380 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -1.9020 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -1.8740 2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.5780 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -1.3080 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -1.0020 2.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -0.9060 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -1.0770 4.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -0.5590 3.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5940 -1.1680 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 0.9310 3.4440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7080 1.1940 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 1.1270 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 1.7730 3.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 1.7430 4.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 3.0470 4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 3.5510 3.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 3.8110 5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 5.1670 5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 5.9380 6.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 5.3580 7.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 4.0080 7.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 3.2340 6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -0.8510 5.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -2.1590 5.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -3.1010 4.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -2.3110 6.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -3.5970 7.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 -3.7930 8.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 -2.7070 8.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1450 -1.4250 8.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -1.2240 7.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 0.9320 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 0.6060 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 0.9250 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.5540 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -1.5020 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -1.6600 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -2.1280 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -2.0780 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.5680 4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -0.8340 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 5.6310 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 6.9900 6.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 5.9590 8.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 3.5580 8.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 2.1850 6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -4.4520 6.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 -4.7920 8.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8460 -2.8600 9.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -0.5800 8.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -0.2180 6.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 0.5920 2.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 2 0 0 0 0 16 56 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 53 1 0 0 0 0 34 35 1 0 0 0 0 34 54 1 0 0 0 0 35 55 1 0 0 0 0 M CHG 1 56 -1 M END