IBS-ZINC02217325 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7030 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0930 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7470 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.9650 -0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0140 -1.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.4620 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0420 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5190 2.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.3990 3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3330 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -1.3750 5.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.4110 5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 0.6830 6.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 2.1700 7.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 2.9340 6.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.9060 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -4.3700 3.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0690 -3.6800 3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -5.7730 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -6.1590 3.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -7.3870 4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -8.1940 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -9.4560 5.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 -9.9220 5.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -9.1220 5.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -7.8400 4.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -7.0430 4.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 -7.5140 4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 -8.7760 5.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 -9.5710 5.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -4.3970 1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 0.8640 4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 0.8400 4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 0.2300 7.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 0.2530 7.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -3.9700 3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -4.5430 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -5.7710 4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -6.4780 3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -7.8490 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -10.0740 5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -10.9020 6.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -6.0630 4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6490 -6.8990 4.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9740 -9.1260 5.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -10.5480 6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -4.9910 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 2.6460 8.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 3.6070 8.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 19 1 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 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 54 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 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 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 54 55 1 0 0 0 0 M END