IFLAB-ZINC05147906 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 0 0 0 0 0 0999 V2000 1.9850 2.8110 -5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 3.3560 -4.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 4.7480 -4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 5.3260 -3.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 4.5220 -3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 3.1430 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 2.5410 -3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 1.0350 -3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 0.5680 -3.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -0.3500 -3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -1.1600 -5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -1.2530 -5.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -1.8610 -5.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -2.4510 -6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 -1.8530 -4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 -2.5380 -5.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -1.0540 -3.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -0.3220 -3.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 0.5000 -2.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 0.9580 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 1.7710 -1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 2.9080 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 4.0950 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 2.6040 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 1.3990 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 4.8400 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 4.4850 2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 3.8600 3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 5.7500 3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7070 -0.9900 -3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 2.6290 -4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 1.8920 -5.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 3.5180 -6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 5.3910 -5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 6.4010 -4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 4.9650 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 2.5340 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 0.6160 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 0.6110 -4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 2.5890 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 3.2460 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 4.8630 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 4.5320 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 3.1020 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 2.2680 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 0.7530 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 0.8060 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 5.2630 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 5.5730 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 3.7780 2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 3.7160 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 2.8770 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 4.4980 3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 6.1930 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 5.5190 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 6.5030 3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4600 -1.6270 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 0.0440 -3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 -1.3220 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 3.6480 0.7710 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3350 3.1940 1.4810 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 18 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 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 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 60 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END