IFLAB-ZINC04087167 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.1520 1.6480 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 0.1320 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -1.8750 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -2.3180 -2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -1.7930 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -0.7380 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 -0.3210 -2.9230 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -1.4990 -4.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -2.2670 -4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -3.3730 -5.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -3.5820 -5.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -4.2040 -5.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -1.5870 -5.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -0.9050 -5.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -0.1540 -4.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -1.1950 -6.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7400 -0.3810 -6.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 -2.6880 -6.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 -0.7800 -7.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -0.0310 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 2.0830 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 2.0450 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 1.9910 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -0.2750 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.2630 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -2.0660 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -2.3850 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -3.4120 -2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -1.9460 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 -4.1200 -4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -4.9620 -5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 -2.2190 -5.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2990 -0.6450 -5.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3950 -0.5600 -7.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5340 0.6950 -6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 -3.3190 -6.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5140 -2.8940 -7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2460 -3.0150 -5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 0.2640 -7.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3670 -0.8800 -8.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 -1.3920 -7.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -0.3310 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 1.0540 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -0.3740 -1.2250 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1500 0.0960 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 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 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END