ACROSORGANICS-ZINC04284464 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 0.0180 1.5210 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.0050 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -0.5750 0.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1350 -0.1210 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -0.2430 1.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -2.3790 -0.2070 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -2.6290 -1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -2.8720 1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 2.0910 -0.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1170 1.6360 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 1.7600 -1.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 3.8950 0.2170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 4.3900 -1.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 4.1440 1.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.9940 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 1.7690 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.2520 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -0.4770 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -1.0630 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 2.5810 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -2.6580 -0.5390 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8760 4.1720 0.5500 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 22 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 -1 M END