IBS-ZINC06662758 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.9420 -1.2110 0.0320 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 0.1550 0.5520 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 0.8890 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 0.8100 1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 1.6300 2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 2.5280 3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 2.6080 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 1.7920 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -0.4640 0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -1.1250 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -1.3420 2.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -1.5860 1.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0890 -1.2540 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -0.5830 -1.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -0.3600 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -0.2130 -0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 0.3920 -1.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -1.5800 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -3.1050 1.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7520 -3.3710 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -3.6130 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 -3.3690 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -4.0040 1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 -4.8840 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 -5.1370 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -4.5000 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -4.5580 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -5.2370 -1.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -3.7500 0.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -0.8690 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -1.7680 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.8580 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 0.1080 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 1.5670 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 3.1680 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 3.3100 3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 1.8570 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -1.1360 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -2.6830 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8100 -3.8110 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0350 -5.3760 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -5.8250 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M END