IBS-ZINC04786003 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.3330 1.3520 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.1760 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.6220 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -2.1500 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -2.5960 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -4.0590 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -4.6940 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -3.9490 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -4.5900 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -5.9750 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -6.7260 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -6.0960 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -6.8870 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -6.2080 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -4.7470 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -4.1460 -2.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -6.9510 -2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -7.1310 -3.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -7.4340 -2.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -8.2690 -4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 -8.6760 -4.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 -7.8820 -5.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -8.2510 -5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9030 -9.4180 -5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -10.2180 -4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8610 -9.8440 -4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9050 -11.2980 -4.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9700 -11.3640 -4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1260 -9.9980 -5.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -8.2340 0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 1.6700 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 1.7110 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 1.7640 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -0.5870 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.5340 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -0.2100 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -0.2630 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -2.5620 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -2.5080 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -2.1840 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -2.2370 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -2.8710 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -4.0090 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -6.4620 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -7.8030 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -7.2300 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -7.7040 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -9.1600 -3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -6.9720 -5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 -7.6300 -6.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 -10.4640 -3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6880 -12.0000 -5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8870 -11.7260 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -8.6510 -0.8000 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 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 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 30 54 1 0 0 0 0 M END