IBS-ZINC02152128 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0390 1.3190 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.1940 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -0.6740 0.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1160 -0.3550 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -2.1780 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -2.7150 1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -2.9210 -0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -4.2640 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -5.0150 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -6.3670 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -7.0030 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -8.4510 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -9.0100 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -8.1940 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -8.7070 0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -6.8670 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -6.2500 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -4.8780 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -9.3000 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -0.0990 1.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 0.7500 1.4710 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 1.1150 2.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 1.6970 0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -0.3730 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -1.0920 2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 -1.9730 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6630 -2.1350 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 -1.4150 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -0.5310 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 -3.0960 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 1.6730 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 1.5460 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 1.8140 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -0.6950 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.4280 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -4.5250 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -6.9440 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -10.0750 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -4.2900 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -9.6400 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -10.1620 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -8.7100 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -0.2170 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9540 -0.9660 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7650 -2.5360 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3390 -1.5420 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 0.0340 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7270 -2.5740 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6050 -3.4980 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7820 -3.9130 0.8080 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 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 38 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 17 18 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 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 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 M END