IBS-ZINC06661717 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -0.9540 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -1.4320 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -1.0560 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -0.5820 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -0.6020 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -1.0530 2.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -1.2970 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 -1.1540 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -1.5540 3.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 -0.7840 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -0.3590 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -0.2760 0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2360 -0.8770 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 -0.4260 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9740 0.9050 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3780 1.3210 -1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 0.4020 -2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 -0.9330 -2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 -1.3450 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8820 0.8090 -4.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 -0.1920 -5.1900 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 -1.4460 -0.9140 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -1.7660 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -1.8560 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 -1.0950 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -0.2510 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7310 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 -0.2390 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -1.9100 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 1.6200 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 2.3610 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 -1.6510 -3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 -2.3850 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6860 -0.9550 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 -0.6510 -5.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2960 0.2650 -6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END