IFLAB-ZINC04497214 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 1.1700 -0.8280 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1020 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5410 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -2.6680 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.5810 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1840 -1.9000 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1930 -3.0000 0.5540 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2950 -3.0640 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5160 -4.2690 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 -3.9120 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -4.7100 -0.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4940 -2.7710 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6140 -3.2660 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5450 -3.9020 1.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9390 -3.0340 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0080 -2.3970 -1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1540 -3.5710 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2420 -4.3090 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5270 -4.6240 1.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8360 -5.1380 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3480 -4.1130 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5350 -3.4290 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1030 -2.8030 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4680 -2.8560 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2730 -3.5280 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7220 -4.1590 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -0.1980 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.4520 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -1.4630 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 1.1810 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0350 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -3.7470 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.5990 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -1.1350 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 -1.4540 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 -5.1180 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 -4.4880 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5500 -2.2640 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4050 -4.5910 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4780 -2.2780 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9120 -2.3710 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3410 -3.5630 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3580 -4.6790 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 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 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END