IBS-ZINC02208565 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.2210 1.4650 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.0610 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -0.5590 -0.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -1.9070 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -2.7270 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -4.1150 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -4.6620 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -3.8360 -1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -2.4600 -1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -1.6510 -2.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -4.9930 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -6.3250 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -7.3840 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -7.1560 2.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -8.5950 0.6280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -8.7890 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -7.2030 -1.0320 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -9.9910 -1.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -11.1620 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -11.1140 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -12.3000 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -13.4840 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -13.4950 -0.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -12.3900 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 1.8790 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 1.7580 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 1.8450 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -0.3550 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -0.4760 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -2.3000 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -5.7320 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -4.2580 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -1.3560 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -4.5790 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -10.0290 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -10.1760 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -12.3020 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -14.4110 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -12.4390 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 M END