IBS-ZINC05458690 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 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 0.7410 -0.5120 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.0100 2.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0300 1.1000 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -0.5210 2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -0.1610 1.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.5350 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 0.6520 1.3090 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 0.3680 0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 0.3820 2.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 2.3740 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 3.0430 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 4.3940 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 5.0840 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 4.4170 2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 3.0560 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 5.1530 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 6.4950 3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 6.7580 5.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 7.9140 5.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 7.8620 7.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 6.6260 7.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 5.5290 7.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 5.5650 5.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 4.6110 4.9720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.4700 3.7410 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 0.7340 -1.6020 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -0.1560 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -1.6060 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -0.0740 3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -0.0970 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -1.6210 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 2.5060 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 4.9110 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 6.1400 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 2.5340 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 7.2150 3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 8.8560 5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 8.7640 7.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 6.5750 8.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -0.0940 3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -0.0990 4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -1.5600 3.7580 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 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END