IBS-ZINC05157031 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 0.8050 2.2110 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 0.6930 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 0.1070 1.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -0.0560 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -1.4270 2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -0.2960 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -0.8520 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 -1.2500 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 -1.0950 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -0.5420 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -0.1470 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 -1.5300 1.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7920 -2.2400 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -0.3080 1.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2990 0.1640 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2860 0.6880 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 1.9000 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6620 1.4440 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9100 0.4520 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9920 -0.7600 1.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2930 -1.4610 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3390 -2.6460 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -3.2590 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -3.7260 -1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 -3.2000 -2.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4610 -4.7260 -2.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 -5.0850 -3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 -6.4090 -4.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 -6.7600 -5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7910 -5.7950 -6.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 -4.4760 -6.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 -4.1180 -4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2140 -1.6740 2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 2.4430 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 2.6470 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 2.6250 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 0.4620 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 0.2800 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 0.0170 3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 0.7250 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -1.5010 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -2.2080 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -1.5490 3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -0.9720 3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -1.6820 3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 -0.4230 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 0.2810 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4980 0.2080 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 1.0130 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 2.6100 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 2.3790 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8690 0.9610 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3160 2.3070 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 0.1260 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 0.9370 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 -0.7590 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3220 -1.8200 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 -3.1370 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4920 -3.3560 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -2.9020 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 -4.0880 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -5.1970 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 -7.1630 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -7.7900 -5.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 -6.0730 -7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 -3.7250 -6.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -3.0870 -4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1210 -2.0030 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 -2.1680 -0.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 69 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 22 69 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 23 69 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 30 31 2 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 33 68 1 0 0 0 0 M END