PUBCHEM-ZINC06044192 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.1920 1.2760 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -0.2260 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.9250 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.3270 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -2.9950 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -4.3980 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -5.0580 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -4.3410 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.0340 2.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -2.2520 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -0.8800 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -0.1360 -2.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 0.2200 -3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -2.9360 -2.6940 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3480 -3.2330 -3.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -3.2020 -3.3470 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7950 1.7190 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 1.6210 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.5720 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.4050 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -4.9380 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -6.1350 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -4.8750 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -0.6320 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 0.8220 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.6880 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 0.7920 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 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 10 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 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END