IBS-ZINC04019437 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0590 1.4800 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 0.0520 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -0.5720 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -1.9580 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.5940 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -1.8420 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -0.4500 3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 0.1800 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.5220 4.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -3.5200 5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -4.0740 6.2640 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -2.9450 5.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -2.1800 4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -1.1270 4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 0.0120 4.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 -2.8210 6.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 -3.6280 7.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -4.4650 7.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 -3.4970 8.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 -2.6310 7.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3780 -2.5080 8.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6900 -3.2220 9.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7640 -4.1180 9.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 -4.2700 9.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5630 -5.1560 9.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -5.8580 11.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 -5.7060 11.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0720 -4.8620 11.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 1.8640 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 1.8490 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 1.8170 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -2.5390 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -3.6720 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 0.1350 3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 1.2580 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -3.9290 4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 -2.1540 6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9320 -2.0470 6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1090 -1.8280 7.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 -3.0990 9.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -5.2830 9.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 -6.5420 11.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 -6.2740 12.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0370 -4.7540 11.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -1.4210 3.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 -0.6620 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 45 46 1 0 0 0 0 M END