PUBCHEM-ZINC06158199 MOE2007 3D CORINA 3.40 0006 02.08.2006 18 18 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.4390 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.1130 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3780 -0.5660 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 0.0600 1.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1310 0.1500 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.9260 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.4600 3.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -0.7470 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -0.5300 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -0.1520 -1.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.9440 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 1.8690 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -0.3500 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.8290 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.4060 1.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 2.1140 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -2.1660 1.9500 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6040 -0.7630 -0.2390 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 15 16 1 0 0 0 0 M CHG 1 17 -1 M CHG 1 18 -1 M END