CHEMDIV-ZINC04149225 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -0.0480 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 0.0620 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -0.2400 -0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 0.5610 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 0.5910 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4580 1.0980 -3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 0.1640 -4.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6730 0.1340 -4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 -0.3730 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9170 0.6710 -5.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 -0.2860 -6.8540 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -0.2000 -8.1880 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2890 -1.2260 -9.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0550 -0.1030 -7.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 1.3280 -8.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 1.3900 -9.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 2.5890 -10.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8250 3.7260 -10.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8090 3.6640 -9.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 2.4640 -8.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 0.1940 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 1.5670 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -0.4140 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 1.2560 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 1.1190 -3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 2.1030 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5210 -0.8420 -4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -0.5310 -5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 1.1400 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -0.3940 -3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -1.3780 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 0.7760 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5110 1.6380 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 -0.9700 -6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 0.5010 -10.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3480 2.6370 -11.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6110 4.6630 -10.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3630 4.5530 -9.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8570 2.4150 -7.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 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 18 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 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 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 M END