IBS-ZINC02104194 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -2.3720 -3.1510 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -2.9250 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -1.8710 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -1.6280 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -0.5630 -1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -0.2590 -1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 0.7300 -2.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -1.1430 -1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -2.2580 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -2.5310 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -3.6590 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -4.4670 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -4.1670 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -3.0570 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 -5.0410 1.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 -4.6850 1.7320 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1090 -3.5990 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 -5.2700 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -5.2740 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -6.0790 3.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 -4.7990 3.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 -5.1800 4.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9370 -6.2190 5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 -4.2480 5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -4.3750 6.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -3.5340 7.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7540 -5.0470 4.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1580 -4.2970 3.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -3.5060 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -2.2260 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -3.9020 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -3.8790 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -2.6040 -3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.9330 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -2.1490 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 0.1440 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -3.9400 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -5.3390 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -2.7870 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 -5.0130 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 -6.3630 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 -4.9130 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1560 -4.1530 3.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3950 -4.4630 6.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 -3.2040 5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 -4.0460 5.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -5.4230 6.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -3.6330 7.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -3.8540 8.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 -2.4750 7.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4120 -5.6970 5.6120 O 0 5 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 36 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 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 M CHG 1 51 -1 M END