IBS-ZINC04859441 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.6920 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -2.0420 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -2.9400 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -4.1860 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -4.0740 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.7720 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -5.2040 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -4.9610 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -6.0200 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -7.3200 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -7.5680 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -6.5180 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 -2.6090 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -3.5640 0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7700 -3.2550 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 -3.9240 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9970 -3.6070 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4670 -2.6300 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5960 -1.9630 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -2.2740 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -3.9460 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -5.8330 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -8.1450 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -8.5850 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -6.7130 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -1.5760 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2880 -4.6870 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6820 -4.1240 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5190 -2.3860 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9700 -1.2010 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 -1.7560 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 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 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END