PUBCHEM-ZINC04948310 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 25 0 0 0 0 0 0 0 0999 V2000 0.2580 1.4370 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.0560 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.4940 0.0160 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.7370 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -0.6190 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -0.9120 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -1.3170 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -1.4430 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -1.1480 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 -1.2180 0.8570 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.7070 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.5600 2.7900 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -1.6600 2.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 0.7820 2.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 1.7360 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 1.7060 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 2.0230 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -0.6150 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.3200 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.3050 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -0.8220 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -1.5410 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 -1.7620 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -0.7270 3.6240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 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 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 24 1 0 0 0 0 M CHG 1 3 1 M CHG 1 24 -1 M END