IBS-ZINC01061009 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.0210 1.4230 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0740 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -0.7590 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -2.1600 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -2.7620 0.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.8490 0.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -2.2300 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -0.8310 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -0.1840 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -0.9140 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -2.2980 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -2.9550 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -3.0090 0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 -2.2730 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1190 -3.2220 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 -4.4120 0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3730 -2.7500 0.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4500 -3.6390 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6890 -3.2880 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7550 -4.1620 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5980 -5.3900 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3570 -5.7530 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2820 -4.8670 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1850 -7.0670 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1040 -7.3800 -1.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 1.7920 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 1.6830 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.8780 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -0.2310 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 0.8880 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -0.4150 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -4.0280 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -1.5520 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 -1.7470 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5290 -1.7930 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8180 -2.3280 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7160 -3.8830 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4330 -6.0710 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3210 -5.1400 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2260 -7.9170 -1.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0650 -8.7650 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 8 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 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 40 41 1 0 0 0 0 M END