PUBCHEM-ZINC04654674 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.6770 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0440 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4340 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.6010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 4.1930 0.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6200 3.9710 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 5.6850 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 6.3740 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 7.7450 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 8.4410 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 7.7520 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 6.3760 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 5.6660 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 4.3040 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 2.1730 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 9.7900 -0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 8.4120 1.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.6130 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -2.0360 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9000 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 3.9500 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 3.9270 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 5.8340 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 8.2870 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 5.5250 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 6.2640 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 3.7370 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 4.4460 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 2.1320 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 1.6970 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 10.2920 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 8.7180 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -0.7950 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -2.4230 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 3.5790 -0.3850 N 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 39 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 27 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 39 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 39 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END