IBS-ZINC04084120 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -4.5260 -6.7210 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -6.3640 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -4.9940 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -4.4120 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -5.1200 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.4360 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -3.0470 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -2.3310 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -3.0020 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -2.1920 0.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4370 -1.1660 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -2.1880 -1.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3960 -3.2280 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -1.5230 -2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -0.0060 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 0.6320 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 0.0020 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -1.5320 -2.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9460 -2.1690 -1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0330 -2.0930 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -2.7030 2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -3.5870 2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -4.9810 2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8160 -5.8460 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0090 -5.3350 3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2210 -3.9580 3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 -3.0880 3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 -1.3950 3.1970 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 -1.8290 -3.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 -7.7640 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 -6.5640 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 -6.0770 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -7.0040 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -6.5120 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -6.2030 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -4.9920 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -2.5220 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -1.2450 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -1.9490 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -1.7550 -3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 0.2550 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 0.4080 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 1.7080 -2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 0.5240 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 0.2880 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 0.4410 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 -1.6920 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 -3.2200 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -1.0630 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9190 -2.6420 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -1.6520 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -3.0490 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 -5.4100 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 -6.9200 3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7720 -6.0080 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1570 -3.5690 4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -1.3700 -3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -2.7350 0.5580 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8060 -3.7340 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 58 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 29 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END