PUBCHEM-ZINC04588711 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5770 -1.7260 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -0.7100 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 0.0380 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 0.3140 1.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 0.9600 1.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5680 1.2370 2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 1.9420 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7780 2.2990 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6990 2.9800 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1890 3.0150 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 2.3860 0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1060 3.9020 -0.7550 I 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 0.3630 -0.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 0.0110 -0.8560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -0.1750 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -1.7270 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4460 0.9230 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8700 2.0930 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6410 3.4000 2.4810 H 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 M END