PUBCHEM-ZINC05408754 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4240 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 -0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.6390 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 0.0980 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -0.5580 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -1.9620 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.6920 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0350 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -2.7530 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -4.1770 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -2.6070 0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -3.5770 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 -1.9240 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -0.5330 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 0.2010 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 1.4210 0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3680 0.1710 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4070 -0.4570 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 1.5140 0.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6840 2.2080 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4400 3.7150 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5560 5.8630 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9280 6.5420 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6620 6.2120 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7840 4.6920 1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3880 4.0680 1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 -2.6110 0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8010 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.7730 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.7880 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 1.1780 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -3.7710 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -4.6260 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -4.4910 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -4.4980 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5730 2.0210 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 2.0010 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1980 1.8590 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8260 3.9220 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 4.0640 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0370 6.0840 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9700 6.2380 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8000 7.6210 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5090 6.1780 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1000 6.6100 2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6560 6.6580 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2680 4.4500 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3790 4.2990 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7980 4.4500 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4720 2.9840 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 -3.5760 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7280 4.4110 0.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 52 1 0 0 0 0 27 51 1 0 0 0 0 M END