ASINEX-ZINC04503564 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -0.0610 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 0.0490 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -0.2420 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 0.5350 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9530 0.5740 2.1720 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.5110 1.1610 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 1.4600 4.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4980 1.8570 5.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7520 1.8340 5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8060 1.3950 4.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0030 1.2120 3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9270 2.2250 6.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2060 3.6530 6.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2200 4.2280 6.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9040 3.5630 7.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5010 5.6680 6.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7170 6.4360 5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9850 7.7780 5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0280 8.3680 6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8090 7.6170 7.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5570 6.2670 7.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3240 5.5310 8.1100 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 0.1720 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -0.1390 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 1.5380 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3820 0.1980 3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7670 1.9270 3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7520 1.3740 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 1.6460 5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6950 2.0250 7.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6600 4.1840 5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9030 5.9780 5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3790 8.3720 4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2320 9.4210 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6210 8.0840 7.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 M END