IBS-ZINC02083246 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 0.1240 1.4970 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.0060 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -0.6140 0.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.9770 1.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 3.2980 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 3.7430 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 2.8060 3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 1.6070 3.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 3.3120 4.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 4.6300 4.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 5.0220 5.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 5.5390 3.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 5.1780 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 6.0130 1.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 1.7950 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 1.9280 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 1.3450 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 4.0070 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 2.7080 5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 6.4790 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.6700 -0.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -1.6330 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 19 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 20 1 0 0 0 0 13 14 2 0 0 0 0 21 22 1 0 0 0 0 M END