IBS-ZINC05307977 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0020 1.3240 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.0650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.7490 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.0400 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.3720 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0450 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 2.0890 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 3.3050 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 1.3430 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -0.0140 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -0.6740 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 2.0050 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5800 2.2380 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9450 2.9300 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4020 3.1590 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7050 2.8040 3.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5860 3.7590 3.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9690 4.0560 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 3.2060 5.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9920 3.5020 6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7260 4.6440 6.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0840 5.4940 5.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7120 5.2010 4.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0660 6.0280 3.6140 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 1.8420 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.6150 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -1.8290 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1250 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 -0.5720 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8390 1.3750 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 2.9630 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 2.8690 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 1.2810 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6680 2.3000 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 3.8870 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1720 3.9840 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0380 2.3150 5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7150 2.8400 7.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0210 4.8720 7.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6570 6.3840 6.1310 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 M END