IBS-ZINC02281060 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 0 0 0 0 0 0999 V2000 0.9120 2.0660 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 0.5820 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.0420 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.4040 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -2.1620 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -1.5180 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -0.1550 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -2.3420 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -3.5830 -2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -4.4730 -3.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -3.0100 -4.9940 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -1.8370 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.6260 -4.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -0.1930 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -1.1160 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -0.6710 -2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 0.6850 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 1.6050 -3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 1.1750 -3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 1.2440 -2.1430 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 2.6250 -1.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6890 0.2870 -1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3350 1.1530 -3.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1600 1.9520 -4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8610 1.8710 -5.6090 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 2.7140 -6.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 3.5440 -6.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 3.1820 -4.6710 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -4.0950 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -3.5430 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 -5.6220 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -3.6670 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -2.0650 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 2.2540 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 2.4520 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 2.5640 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.5430 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 0.3250 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -2.1750 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -1.3820 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 2.6610 -3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 1.8940 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0860 0.5410 -3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 2.7290 -7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 4.3020 -6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -4.0110 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -5.9300 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -5.9900 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -6.0350 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 -4.0830 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -4.0330 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -2.5790 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.0600 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -3.0930 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -1.5190 2.8530 H 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 M END