IFLAB-ZINC04585866 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.8790 -0.6050 1.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -2.3560 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -3.1800 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -4.5430 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -5.1050 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -4.2750 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -2.9130 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -6.5700 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -7.2910 1.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -7.1110 -0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -8.4880 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -9.1380 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -10.5780 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -10.9800 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -9.6060 0.7430 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -8.4480 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -7.2320 -2.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -9.1600 -3.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -8.4700 -4.6020 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 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 1.8810 -2.7450 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -5.1810 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -4.7070 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -2.2720 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -6.5360 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -11.2560 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -12.0130 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -10.1300 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -9.2060 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -7.8600 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -7.8330 -5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 M END