IBS-ZINC04086861 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1690 -0.0010 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -1.5750 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -2.6610 -2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -1.8500 -2.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -1.8240 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -1.0550 -4.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -2.7500 -4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -2.5200 -5.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -3.4460 -6.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -4.6460 -6.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -5.1960 -7.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -6.0600 -7.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -4.3410 -7.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -3.2100 -6.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -2.1670 -6.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -2.2520 -6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -3.3670 -7.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -4.4040 -7.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -2.4650 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -3.7840 -3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -2.5510 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.4860 -5.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -2.7190 -6.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -5.1090 -6.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -1.2960 -5.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -1.4440 -6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 -3.4190 -7.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -5.2690 -8.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -0.9250 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 -1.3660 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 44 45 1 0 0 0 0 M END