IBS-ZINC06665336 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.7880 2.0600 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 1.4320 0.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2660 2.2170 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.9200 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -1.3810 0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -0.7930 -0.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1440 -0.5720 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 0.4060 -0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.7830 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -0.8910 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.0720 4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.0440 4.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 0.3270 5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 1.0230 6.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 1.3260 7.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 0.9340 7.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 0.2860 6.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -0.0200 5.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 -0.0690 6.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 1.1900 8.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 1.4140 10.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 1.6120 10.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 1.4670 9.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9560 1.5460 10.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4870 1.1790 8.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 1.4160 10.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 2.5640 11.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 2.5640 12.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 1.4190 12.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 0.2700 11.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 0.2670 10.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 2.9350 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 2.3750 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 1.3640 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 0.6430 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 1.6690 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -2.2520 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -1.6480 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -2.7210 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -1.3590 -2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -2.0020 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -0.9100 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -1.9160 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.5630 5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 0.9500 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 1.3550 6.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 1.8830 8.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -0.5370 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 0.3320 7.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 1.8140 11.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 3.4660 11.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 3.4580 12.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 1.4220 12.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -0.6220 11.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -0.6360 10.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.3390 1.9470 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5410 -0.1080 2.1140 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 56 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 56 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END