IBS-ZINC02131509 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.4050 1.0530 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.4130 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.9370 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -0.5300 0.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7250 0.1320 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -0.1400 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -0.9910 -1.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 1.1560 -1.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 1.5280 -2.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8390 0.8620 -2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 2.9710 -2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 3.0610 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 4.7710 -1.3500 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 4.6780 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 1.4140 -3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 1.0570 -3.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -1.9130 0.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -2.9160 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -4.1640 -0.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -4.5590 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -5.9020 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -6.2580 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -5.2980 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -3.9670 3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -3.5850 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -2.1810 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -1.2930 2.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 1.1240 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.4610 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 1.6200 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -1.0020 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.3490 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -1.9820 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -0.8540 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 1.8420 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 3.6270 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 3.2780 -3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3920 2.4050 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 2.7540 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8150 5.6650 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 3.9810 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 4.3300 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -2.6600 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -6.6580 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -7.2970 2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 -5.5970 4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 -3.2240 4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 1.7070 -5.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 1.6180 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 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 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 48 49 1 0 0 0 0 M END