IFLAB-ZINC04497746 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 -9.8880 -3.1590 0.7270 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.9620 -2.7910 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7090 -4.4770 1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9870 -2.1020 2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5770 -0.9060 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5300 -0.2560 3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9020 -0.9240 4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3300 -2.4660 3.7240 S 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 -8.5400 -2.3930 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0540 -0.4760 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9680 0.7190 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7690 -0.5740 5.3590 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 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 30 1 0 0 0 0 8 31 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 32 1 0 0 0 0 10 33 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 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 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 23 39 1 0 0 0 0 M END