IBS-ZINC05025880 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.0200 1.5680 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.0610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.6140 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -1.9970 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.7080 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -2.0390 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.6500 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 0.0320 -2.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 0.3510 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 0.0540 -2.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 1.0680 -4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 1.4280 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 2.2860 -6.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 1.0110 -4.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 1.2960 -5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 0.7190 -4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3100 1.0160 -5.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 0.4630 -4.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1740 1.1060 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1150 0.2380 -2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9630 -0.9040 -3.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9680 -0.7740 -4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 1.3860 -4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 1.9770 -5.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 1.0040 -4.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 0.3580 -3.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 0.0460 -2.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 1.9330 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.9180 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.9420 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.0620 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.5230 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.7880 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.5940 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 1.7400 -6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 2.5380 -6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 3.2010 -5.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 0.5230 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 2.3750 -5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 0.8410 -6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -0.3600 -4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 1.1740 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4330 2.0940 -5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2680 0.5610 -6.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0250 2.1140 -2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8610 0.4270 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6190 -1.5310 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 1.2050 -4.5500 H 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 M END