IFLAB-ZINC02456190 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 22 0 0 0 0 0 0 0 0999 V2000 -0.0530 1.3700 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.0250 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6820 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0350 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 1.4340 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 2.1220 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.6350 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 4.2430 -0.1000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6180 -0.6110 0.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -2.0600 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -2.8100 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -4.0430 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.0820 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 1.8800 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -0.5790 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 2.0120 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 -0.0630 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -2.4190 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 -2.3330 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -2.6030 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 4.1850 -0.3050 O 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 14 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 21 2 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 20 1 0 0 0 0 M CHG 1 8 -1 M END