IBS-ZINC05304779 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 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 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.8990 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -1.3450 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -1.3820 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.9740 -3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.5320 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.6550 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.3640 2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -1.1640 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -1.3520 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 -1.8500 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -1.9520 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -1.5220 0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -1.4790 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4950 -2.4210 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6320 -2.7820 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6840 -2.6850 1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5930 -2.2240 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 -2.1310 3.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8680 -2.5290 4.5510 C 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 2.5510 -0.8700 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -1.6640 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -1.7300 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -1.0030 -4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.2170 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -1.1560 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 -2.5010 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4920 -3.1440 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5830 -2.9720 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6860 -1.9100 4.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0710 -3.5750 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7780 -2.4060 5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 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 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END