IBS-ZINC02331291 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8250 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.6740 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -4.0400 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -4.5870 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -3.7320 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -2.3480 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -4.5960 3.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -5.9080 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -5.8890 1.9650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -6.6770 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -6.9560 3.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -8.1220 3.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -6.6340 5.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -5.3330 5.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -4.3570 4.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -7.6950 5.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 -8.0430 5.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -9.1510 6.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -9.4770 6.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.2560 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -4.6880 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -1.6880 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -5.1020 6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 -7.3520 6.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -8.5790 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0660 -8.3860 4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7060 -7.1590 5.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -8.8090 7.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 -10.0360 6.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 -10.1740 6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END