IBS-ZINC02087229 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -0.7280 3.9740 P 0 0 3 0 0 0 0 0 0 0 0 0 2.2290 -0.2150 3.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.1400 5.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.5400 6.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.0540 7.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -0.8630 8.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -0.4170 9.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 0.8370 10.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 1.6460 9.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 1.1980 8.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -2.3370 3.9650 O 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 1.8840 -0.7620 -1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.5210 0.0070 H 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 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.9610 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.5720 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 0.9460 5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -0.5880 5.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -1.6260 6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -0.0920 6.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -1.8430 8.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -1.0490 10.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 1.1860 11.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 2.6260 9.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 1.8280 7.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.7430 3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.6210 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.1480 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -0.9360 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 18 37 1 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 M END