CHEMDIV-ZINC06944958 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 0.2520 1.2240 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -0.3050 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -0.7560 -0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -2.0740 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.8870 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -2.5380 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -4.0690 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -4.5340 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -4.0120 -1.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 -2.5440 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -2.0190 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -4.5210 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2010 -4.1440 -2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5490 -4.7450 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -5.6230 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 -5.8640 -0.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -5.3640 -0.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2360 -6.2790 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1700 -4.2550 -3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3070 -3.4310 -4.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 -3.3720 -3.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5710 -2.7360 -5.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 -2.1200 -5.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0610 -1.4360 -6.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0920 -1.3630 -7.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 -1.9790 -7.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5990 -2.6580 -6.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3470 -0.6900 -9.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3050 -0.6550 -9.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5670 -4.5850 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 1.5600 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 1.5990 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.6040 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.6850 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.6790 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -0.1060 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -2.1570 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -4.4500 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -4.4430 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 -5.6230 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -4.1630 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -2.1880 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 -2.1830 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -0.9300 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -2.3690 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1990 -7.2280 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5200 -6.4560 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9710 -5.6260 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5560 -2.1770 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0180 -0.9570 -7.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 -1.9220 -8.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 -3.1330 -6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6390 -0.0880 -10.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4220 -0.1800 -9.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 -1.6730 -10.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2790 -3.9320 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6410 -4.4370 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7930 -5.6240 -3.9140 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 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 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 6 11 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END