IBS-ZINC02257111 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.7660 1.4320 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -0.0190 0.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.7100 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -2.0870 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.7370 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -3.9420 -0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -2.0100 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -0.6800 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.0580 -2.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -2.6820 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -2.5050 2.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -1.4010 3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3450 2.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.3860 4.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -2.5870 5.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.1190 6.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -0.6230 6.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.2670 5.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 0.8620 4.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -3.8780 2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -4.1060 2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -3.2090 2.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -5.4160 3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -5.6310 3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -6.8610 3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -7.8820 4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -7.6770 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -6.4510 3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 1.9340 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 1.7250 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 1.7170 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -2.9900 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -1.9960 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -3.5580 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.3360 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -2.9940 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -2.2400 7.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -2.6490 7.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.0260 7.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -0.4780 6.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -4.0370 3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.5770 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -4.8350 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -7.0280 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -8.8440 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 -8.4790 4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -6.2910 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 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 10 1 0 0 0 0 8 9 2 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 20 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 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END