PUBCHEM-ZINC00402372 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 22 0 0 0 0 0 0 0 0999 V2000 -0.0150 1.3810 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -0.6630 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 0.0060 -0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.3300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.0580 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 2.0400 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 1.3130 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 1.9900 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 3.3740 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 4.0330 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 3.3640 -0.1200 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4840 4.0750 -0.2160 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9490 1.9190 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5620 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -1.7410 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 3.1360 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 0.2360 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 1.4530 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 3.9310 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 5.1100 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 14 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 M CHG 1 12 1 M CHG 1 13 -1 M END