ACROSORGANICS-ZINC01687028 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.5660 1.4400 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -0.0340 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.7160 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -2.0650 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -2.7430 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.0490 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -0.7010 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 0.0360 -2.3700 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.5670 -3.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 1.2440 -2.3300 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5990 -4.1880 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -4.7890 0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 0.0050 2.4940 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4000 -0.6140 3.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 1.2170 2.5250 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3320 2.0090 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 1.6820 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 1.6950 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.5960 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -2.5670 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -4.8390 -1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -5.7840 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 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 13 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M CHG 1 13 1 M CHG 1 15 -1 M END