ANALYTICONDISCOVERY-ZINC05414184 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 1 0 0 0 0 0999 V2000 -4.3800 1.4580 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -0.0490 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -0.6610 2.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -0.7790 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -0.0770 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -0.7640 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -2.1480 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -2.8560 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -2.1770 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -4.2550 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -4.9380 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 -4.3410 0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -6.2820 0.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 -7.0240 0.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6020 -6.5270 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -8.4490 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -9.2240 -0.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3730 -9.2730 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -7.8480 1.9180 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3420 -7.3500 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -7.0730 1.7940 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4840 -7.5700 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 -5.7420 2.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -7.8930 3.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7510 -10.6280 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -11.1270 -0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 -11.3280 -1.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 -12.6920 -1.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8440 -13.1900 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9300 -13.4670 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2870 -13.6210 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0620 -12.6620 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3900 -12.8000 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9420 -13.9030 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1650 -14.8640 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8440 -14.7240 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2640 -14.0420 4.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7680 -15.2020 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 -12.6440 -2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 -11.5760 -3.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9630 -13.7890 -3.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9580 -8.5720 -0.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 1.8160 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 1.8200 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 1.8260 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 1.0030 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -0.2210 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -2.6790 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -2.7250 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -4.7340 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -6.7580 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -8.4150 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -8.9470 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3080 -9.8250 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 -9.7700 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 -5.6960 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 -8.3700 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6890 -10.9280 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7230 -12.9220 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 -14.4520 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4100 -11.8030 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9950 -12.0510 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8150 -15.7240 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2420 -15.4740 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 -15.1890 5.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1500 -16.0970 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -15.2050 4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 -14.6440 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 -13.7580 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8200 -9.0090 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 2 0 0 0 0 2 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 46 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 7 8 2 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 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 51 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 39 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 34 35 2 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 35 63 1 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 68 1 0 0 0 0 41 69 1 0 0 0 0 42 70 1 0 0 0 0 M END