IBS-ZINC00529149 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0340 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6840 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -1.9880 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -2.2590 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -1.1390 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -0.1220 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 -1.0180 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 -2.1660 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4440 -2.0520 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0400 -0.7880 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2440 0.3600 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 0.2460 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5120 -0.6670 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2050 -1.6660 -0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0870 0.5520 -0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5470 0.6730 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9370 2.1530 -0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 13.4490 2.6750 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4710 2.3060 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7880 3.5120 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4080 3.9460 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5840 2.7620 1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9890 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 -3.1430 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0590 -2.9400 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7050 1.3370 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 1.1340 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5350 1.3490 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9600 0.1860 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9440 0.1960 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9690 1.4080 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7670 2.5150 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4430 3.2110 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2410 4.3180 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4930 4.2680 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9920 4.7440 0.6280 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 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 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END