IBS-ZINC05490042 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.0230 1.4940 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.0360 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4240 -0.4130 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -0.5390 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -2.4860 1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -1.9820 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.5140 0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -0.0130 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 0.8300 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 1.3240 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 0.9770 -2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 0.1350 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -0.3540 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 1.4640 -3.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 1.0660 -5.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.5330 2.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6630 -2.0780 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -2.2010 3.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -4.0280 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -4.6340 1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -4.7260 2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -4.1850 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -5.1630 4.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 -5.0240 4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -6.3900 3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -6.1800 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -7.2560 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -8.5290 2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -8.7390 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -7.6820 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.8500 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.8510 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.8720 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -0.2100 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.1390 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -2.1080 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -3.5760 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -2.3820 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -2.3110 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 1.1000 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 1.9800 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -0.1350 -4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -1.0060 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 1.3900 -5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -0.0190 -5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 1.5230 -5.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -2.5920 4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.1200 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.6560 3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -3.1370 3.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -7.0940 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -9.3660 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -9.7410 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -7.8570 4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -2.0080 1.1890 N 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 7 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 55 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 55 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END