PUBCHEM-ZINC05390301 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 -0.0510 1.8770 1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 1.1890 0.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2430 1.9310 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 0.8210 0.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2430 1.6340 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 0.5140 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 1.3170 -2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 0.8930 -3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -0.3050 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 -1.0500 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -0.6310 -1.4380 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.3350 -0.6760 -4.9120 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0000 -0.3590 0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -0.0430 0.3980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8160 -0.4570 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 0.3120 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -0.1940 1.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 2.2180 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 2.7640 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 1.2150 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 2.2600 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 1.5250 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -1.9930 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -1.1570 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.7530 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 1.0550 -0.0520 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3420 -1.1140 1.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -0.9240 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -1.9800 1.0350 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 14 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 11 1 M CHG 1 12 -1 M CHG 1 26 -1 M END