PUBCHEM-ZINC05353769 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -0.6850 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 0.0300 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.6600 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -2.0480 -3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -2.6940 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -2.0090 -1.0490 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0070 -2.7320 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -2.8280 -4.1870 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9220 -2.2520 -5.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -4.0450 -4.1490 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.4990 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.1100 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -0.1320 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -3.7730 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -2.9240 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -3.6780 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.1300 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 1 M CHG 1 12 -1 M END