IBS-ZINC05207183 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 4.1870 1.7190 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 5.9260 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 6.7730 2.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 6.4160 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 8.1090 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 8.8790 3.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 8.5920 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 7.6910 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 6.3790 0.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 8.1510 -1.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 9.4100 -1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 9.7980 -2.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 10.3440 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 10.0720 0.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6060 10.5890 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 10.5710 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 11.5420 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 12.0010 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 11.4870 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 10.5130 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 10.0530 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 11.9370 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.4150 -0.0220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -0.4970 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 3.9460 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 7.5600 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 11.3750 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 10.1880 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 11.9420 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 12.7600 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 10.1110 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 9.2910 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 11.4390 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 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 40 1 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 29 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 M END