PUBCHEM-ZINC05376613 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.7750 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 0.2540 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.4080 -1.0690 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2840 -0.0130 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 0.0070 -1.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6110 -0.2960 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 2.2360 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 -0.4460 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 0.4490 0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -1.9300 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -2.4220 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -1.5770 -2.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 2.1200 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 2.2300 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -0.0850 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -0.0330 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 3.3110 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 2.0090 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -2.3900 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -2.3390 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 1.5480 -1.0720 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2130 1.6930 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 1.8990 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -1.5330 0.6480 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1270 -3.6340 -1.3590 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 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 1 0 0 0 0 5 8 1 0 0 0 0 5 21 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 24 -1 M CHG 1 25 -1 M END