PUBCHEM-ZINC05381393 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.3870 1.3110 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 0.9330 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 1.5630 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.4890 -1.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -1.3440 -1.0450 P 0 0 3 0 0 0 0 0 0 0 0 0 2.8400 -0.6860 -0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -1.4420 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -2.8290 -0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -2.8680 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -2.8080 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -2.8490 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -2.9480 3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -3.0080 3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -2.9730 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -2.9900 4.7700 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5260 -2.9380 4.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -3.0780 5.6950 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0260 0.8620 -3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 0.9440 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 2.3950 -2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 1.2990 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 1.2590 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 1.2300 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 2.6490 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.4370 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.0210 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -1.9270 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -2.7300 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -2.8030 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -3.0840 3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -3.0240 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END