IBS-ZINC02083244 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 0.0410 1.4260 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.1060 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.6580 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -2.1850 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -2.8490 -0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 1.9970 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 3.5260 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 4.0470 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 5.3720 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 5.8960 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 5.0240 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 3.7960 0.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 5.6930 0.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9450 7.0490 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 7.5500 0.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 7.8130 0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 7.3650 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 8.1420 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 1.7770 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.8050 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -0.4880 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.4600 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.2700 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -0.2990 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 1.6480 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 1.6190 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 3.8770 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 3.9070 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 3.3780 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 6.0260 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 5.1240 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 8.8160 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -2.6010 -0.4320 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 M CHG 1 33 -1 M END