IBS-ZINC04090172 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2180 -0.6660 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 0.0020 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.3280 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.0600 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 2.0390 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 3.2570 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 1.3080 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 1.9680 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 1.2360 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 -0.1530 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5870 -0.8340 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7820 -0.1320 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7640 1.2470 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5680 1.9380 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 3.4370 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 3.9500 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 3.3530 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8140 -1.0240 -0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2140 -2.3130 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8760 -2.1630 0.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9220 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5620 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -1.7460 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 3.1400 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 0.2280 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4600 -0.6920 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6920 1.7840 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8070 3.8870 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3530 3.7210 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1950 5.0360 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0870 3.6680 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 3.8990 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1930 -2.5440 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7490 -3.0860 0.2320 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 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 25 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 M END