IFLAB-ZINC04263839 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.5080 1.5050 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 0.0070 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.6670 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0410 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.7490 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -2.0750 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -0.6880 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -2.8270 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -2.2380 -3.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -4.1660 -2.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -4.8630 -3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -6.1480 -3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -6.8480 -4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -6.2660 -6.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -4.9620 -5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -4.2700 -4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -4.6580 -7.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -3.6220 -7.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -5.7200 -8.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -6.7080 -7.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -7.7840 -7.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 1.7500 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 1.9150 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 1.9320 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.1170 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.5610 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -3.8220 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -0.1600 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -4.6450 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -6.6010 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -7.8460 -5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -3.2730 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -5.7680 -9.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 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 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 M END