IBS-ZINC00627884 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.6780 0.3500 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 0.3980 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 0.0540 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 0.4220 3.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -0.6680 2.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -1.1000 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -0.7880 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -1.2280 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -1.9570 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -2.2640 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -1.8440 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -2.9890 0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -4.3220 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -4.8320 -0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 -5.1810 -0.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4090 -4.8910 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 -4.9900 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 -6.5880 -0.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2720 -7.4730 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -7.1040 -1.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 -8.7660 -0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 -9.6620 -1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 -11.0570 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5320 -11.9240 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -13.2030 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -13.6160 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -12.7490 -2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 -11.4710 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -2.5040 -2.6680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 0.9350 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -0.5640 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 0.9340 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 0.9810 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.9930 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -2.0870 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 -5.2790 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 -3.9430 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5950 -5.6110 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 -6.8820 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 -9.6640 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 -9.3260 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1390 -11.6020 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2060 -13.8810 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -14.6150 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 -13.0710 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 -10.7950 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END