PUBCHEM-ZINC01845689 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0860 1.5070 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0020 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.6300 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -0.6010 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -1.7370 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -2.3700 -1.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -2.2050 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -3.5800 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 -4.0580 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -3.1710 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -1.7910 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -1.3080 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0620 -3.6880 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 -4.9490 -0.3210 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9030 1.9750 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 1.9560 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.7570 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.1990 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -0.1970 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -0.4770 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -1.7110 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.1790 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -4.2860 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -5.1310 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -1.0880 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -0.2340 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 -2.8220 -0.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 2 0 0 0 0 M CHG 1 14 -1 M END