IBS-ZINC02358640 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.1250 1.2930 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.0970 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -0.7390 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -0.0010 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 1.3890 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 2.0420 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 2.1530 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 3.3770 -0.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 1.3990 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 0.0240 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -0.6840 -0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 2.0740 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 2.2600 1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 2.7720 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 3.0390 2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 4.0260 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 3.4880 3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 3.2130 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1400 4.2610 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 3.3520 5.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9370 5.5150 5.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2040 6.6330 4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 7.4500 6.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 7.2980 7.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5010 5.8730 6.8590 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1060 5.1620 7.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0490 5.9370 6.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6650 6.2280 5.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 1.7920 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -0.6830 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.8230 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 3.1250 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 -0.4660 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 1.4600 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 3.0440 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 1.2830 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5910 2.0380 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 3.6960 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5690 2.0880 3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5120 3.4370 2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6140 4.9730 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 2.5620 4.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 4.1930 4.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 4.1650 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 2.7880 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 7.1890 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 6.3120 4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 8.4930 5.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 7.0130 6.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7500 8.0560 6.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7150 7.4440 8.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5130 5.7360 8.1160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 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 25 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 M CHG 1 52 -1 M END