IFLAB-ZINC03861148 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.5170 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.0040 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.5140 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.0100 1.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7270 -0.4210 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.5450 1.1390 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8440 1.9760 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 2.0470 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 2.1620 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 1.4230 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -0.5880 2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 0.1590 3.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 1.8480 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.9400 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -0.3500 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.4290 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.2070 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -1.6110 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 1.7400 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 3.1440 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 3.3780 1.2620 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2360 -1.8000 2.3860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 -1 M END