IBS-ZINC02586313 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 0.5720 0.9690 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.4790 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -1.2950 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -2.6380 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -3.1800 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -2.3660 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -1.0220 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -4.5830 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -5.4720 0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -4.9600 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -6.3800 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -6.4630 -3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -7.4940 -3.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -5.1690 -3.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -4.1690 -2.8810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8670 -3.4240 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -3.5280 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -2.1340 -3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -1.5330 -3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -2.3070 -3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -3.6920 -3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -4.2970 -3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -1.5970 -3.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 -2.3440 -4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -1.3610 -4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 -1.3140 -3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -4.8310 -5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.9000 -5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -5.1510 -7.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -3.3410 -7.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -7.3160 -1.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 1.5700 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.3280 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 1.1210 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.8910 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -3.2570 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -2.7700 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.4050 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -1.4990 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -0.4510 -3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -4.3350 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -5.3820 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -2.9900 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -2.9520 -4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 -0.6430 -4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3870 -2.0050 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0730 -0.5700 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -3.8370 -5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -5.5560 -5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -5.8800 -5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -4.1280 -4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -4.4970 -6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -6.1930 -6.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -5.0660 -8.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -3.1340 -7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -2.6310 -6.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -3.3130 -8.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -6.3910 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -4.7290 -6.8930 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1980 -5.3760 -7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 58 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 59 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 59 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 59 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END