PUBCHEM-ZINC04201349 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.0050 1.6050 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 0.1300 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.7300 -1.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2580 -0.5880 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.2010 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -2.7130 -0.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -0.4280 -1.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 0.5490 -2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 1.2520 -2.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 0.7170 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 1.2280 -3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 1.4100 -3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 1.0930 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 0.5970 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 0.4120 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 2.0790 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.7380 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 2.1350 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 0.0400 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -0.2380 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -1.0660 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 1.4810 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 1.8010 -4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0280 1.2360 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 0.3600 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 0.0500 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -2.7010 -0.9050 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 M CHG 1 27 -1 M END