PUBCHEM-ZINC05836887 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 1 0 0 0 0 0999 V2000 0.6180 1.8430 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 0.6880 -1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.2720 -0.2980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2330 -0.7550 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 0.6190 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 1.8670 0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 0.0900 1.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -1.0130 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -1.6120 -0.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -1.2970 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -1.8650 -2.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -3.0420 -2.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6230 -3.0130 -3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -4.3180 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -4.7350 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 -5.1020 -1.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.9700 -4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -2.2200 -4.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 2.7850 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -1.5190 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -1.4750 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -4.2020 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -5.1550 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -4.7270 0.0710 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3550 -3.6390 -5.2240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 25 -1 M END