PUBCHEM-ZINC02036658 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 0.4020 0.9910 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.4690 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -1.1350 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -0.6140 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -0.0500 -1.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9300 1.0340 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -0.2770 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -1.4140 -1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 1.0660 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 1.4580 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 1.5760 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -0.9930 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -0.6520 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.1940 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -1.0770 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -1.6740 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -0.1120 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -2.3880 -3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 0.7110 -0.8830 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4360 -0.5980 -2.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -0.1450 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -2.0400 -2.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 -2.2070 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 18 22 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 19 -1 M END