IBS-ZINC06785989 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.3820 0.6370 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 0.5120 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 1.7190 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 2.1720 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 1.3950 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 2.7000 -2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 2.5330 -3.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 2.8030 -3.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8010 2.1640 -3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 2.4920 -5.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 2.0680 -5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 2.1140 -5.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 1.8140 -5.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 1.7260 -7.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 2.6000 -5.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 2.4270 -6.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 2.9070 -4.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 3.9690 -4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 4.2190 -3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1910 3.4760 -2.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3640 2.4680 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 2.1410 -3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 4.2520 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 4.5900 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 5.9190 -2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 6.9110 -2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 6.5730 -3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 5.2420 -4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 7.8180 -4.7520 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 1.5870 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 0.5940 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -0.1820 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 0.5800 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -0.4500 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 2.4540 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 0.7540 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 2.2640 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 3.1370 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 1.4370 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.0980 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 0.6140 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 3.5000 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 2.9540 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 2.5220 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 4.5820 -5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8470 5.0350 -3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4350 1.8860 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 1.3110 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 3.8160 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 6.1820 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 7.9490 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 4.9780 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 1.5950 -0.9440 N 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 53 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 M END