IBS-ZINC02195980 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3850 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 1.2140 -0.6620 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 0.0170 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 1.3390 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.0670 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 3.4860 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 3.4920 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 2.2170 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 4.7330 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 5.8390 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 5.7850 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 4.6410 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 4.8060 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 6.2040 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 6.2430 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 4.1040 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 4.0660 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -2.1680 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -2.7970 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -2.1760 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -0.7240 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.9240 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 6.7070 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 6.7280 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 6.6880 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3150 5.7840 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 7.2780 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 3.5800 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 3.6200 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 4.5250 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 3.0310 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -2.4950 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.4900 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.8730 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -2.5980 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.2100 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -2.7260 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -0.7020 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.2220 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5710 5.5020 1.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5780 5.5560 1.0220 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 41 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 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 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 41 42 1 0 0 0 0 M END