IFLAB-ZINC04940578 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.7010 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -2.1230 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -3.1150 -1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -4.4190 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -4.7320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -3.7400 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -2.4340 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.7040 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -1.0960 -3.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -0.4730 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -0.7900 -3.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -1.9960 -4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -2.9850 -3.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -2.0870 -5.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -3.2040 -6.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -3.0580 -7.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -1.8170 -8.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -0.7040 -7.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -0.8440 -6.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 0.2780 -4.9410 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 1.1250 -4.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 0.7450 -5.3880 O 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 0.5290 -0.3650 0.8850 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 2.5450 -0.5230 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.0180 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -2.8710 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -5.1940 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -5.7510 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -3.9840 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -1.6590 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -1.1140 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 0.5710 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -4.1800 -5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -3.9250 -8.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1250 -1.7160 -9.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 0.2690 -7.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 37 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 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 M END