IBS-ZINC05347159 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4250 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 0.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -0.5340 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.9420 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -2.3040 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 -1.1580 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -0.0720 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 0.8610 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 -1.0850 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8820 -2.1030 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8360 0.1090 0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 1.4060 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2750 2.4490 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5470 1.6340 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2160 0.2920 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2360 -0.6620 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5520 -0.2690 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8710 1.0720 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8660 2.0220 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.6880 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.0320 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -2.7490 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -3.0860 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -4.0460 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -4.7050 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.7740 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.7890 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 1.1850 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -3.3100 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4700 1.4650 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 1.5600 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1440 3.0200 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2910 3.1150 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9930 -1.7110 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3360 -1.0120 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9030 1.3780 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1140 3.0700 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -2.1730 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -3.6860 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -3.6560 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -4.4450 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -5.7840 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -4.3880 -1.7810 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 3 4 1 0 0 0 0 3 23 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 22 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END