IBS-ZINC06785989 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.6730 -2.1470 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -2.1910 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -0.6600 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -0.4120 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.3770 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 1.1490 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 1.5810 -3.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 1.9640 -3.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0890 1.1000 -3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 2.2680 -4.9730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7740 2.0790 -5.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 1.6370 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 1.3640 -5.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 2.2390 -6.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 1.3200 -5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 0.1610 -5.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 1.7830 -6.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 1.0660 -6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 1.5000 -7.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1700 2.5750 -8.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9990 3.2390 -8.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 2.8880 -7.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 3.1630 -2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 3.2060 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 4.3090 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 5.3850 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 5.3570 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 4.2610 -2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 6.6840 -1.7330 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -1.4890 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -1.7950 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -3.1490 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -2.5670 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.8300 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 0.1900 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -1.5730 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 0.4970 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -1.2440 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -0.2810 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.8470 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.7840 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 1.5020 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 1.6390 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 3.3090 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5310 0.1910 -5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2660 0.9790 -7.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 4.0890 -8.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 3.4670 -7.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 2.3800 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 4.3310 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 6.2400 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 4.2690 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -0.7910 -1.3130 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6460 -0.1460 -0.5210 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 53 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END