IBS-ZINC05451687 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1070 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5270 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -1.9230 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -2.6720 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0230 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -4.0290 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 -2.6060 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2230 -2.0120 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1100 -3.1210 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 -4.1890 0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -3.9330 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6160 -3.0700 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0950 -3.0460 -1.2480 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.1140 -4.2000 0.7240 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.0370 -1.9170 0.7380 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -0.5680 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 0.0050 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5300 1.3500 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1820 2.1300 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5210 1.5650 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2130 0.2200 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5720 3.8210 0.0990 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 1.1860 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.0540 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -2.5970 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.4170 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4940 -0.6020 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0450 1.7950 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2510 2.1780 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 -0.2200 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 M END