PUBCHEM-ZINC01531039 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0920 1.3630 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.0910 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -0.8010 -0.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -1.6400 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -1.7850 1.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -2.4680 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -2.2130 -0.5550 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2930 1.9920 -0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9300 1.7060 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 3.5430 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 3.8410 1.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 1.9280 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 1.4220 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -0.1240 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.6400 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -0.7440 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -3.3100 1.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 4.2390 -0.7750 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9910 1.4490 1.1920 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7820 0.8310 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 1.0630 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 2.3670 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 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 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 17 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 7 -1 M CHG 1 18 -1 M CHG 1 19 1 M END