CHEMDIV-ZINC06939013 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 -3.0110 3.0430 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 4.3940 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 5.0770 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 4.4080 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 3.0580 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 6.5500 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 7.3190 1.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 7.7260 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 7.5170 3.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 8.4700 1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 9.1090 2.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 9.7210 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 9.6750 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 9.0610 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3550 8.4650 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 7.7180 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 7.5000 -0.9780 O 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 -3.1410 2.5100 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 4.9170 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 4.9420 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 2.5360 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 6.8010 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 6.7910 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 9.1290 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1630 10.2280 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1010 10.1500 0.0140 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 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 31 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 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 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END