IBS-ZINC02295545 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 1.4320 -0.0220 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -1.4830 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -2.2430 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -1.5470 1.5210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9060 -2.5880 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -0.8120 1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 0.1360 2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.9230 2.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.2550 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -1.2780 3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -2.1850 4.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -0.5700 4.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -0.8720 5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.2700 6.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 0.1440 5.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 0.7080 6.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 0.8660 7.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 0.4570 8.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.1130 7.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 1.4230 8.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 1.5560 10.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 0.4170 3.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 0.1110 2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -1.0410 2.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.1750 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 0.8610 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 1.8590 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 3.1690 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 3.4870 1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 2.4980 2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.4320 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 0.0230 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.5190 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -1.9370 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -1.7890 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -3.2840 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -2.1980 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -1.5560 6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 0.0220 4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 1.0280 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 0.5830 9.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -0.4360 8.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4900 2.0140 10.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 0.5720 10.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 2.1850 10.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 1.3220 4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 -0.1610 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9910 1.6170 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 3.9460 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 4.5120 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 2.7470 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 -1.2100 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 -0.7070 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 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 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 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 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 52 53 1 0 0 0 0 M END