ACROSORGANICS-ZINC01683095 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 0 0 0 0 0 0999 V2000 0.1720 1.0500 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -0.4120 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.3750 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -2.0970 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -0.8780 0.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -1.4540 -2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -0.6570 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 0.1220 -3.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 1.2030 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 1.6510 3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 1.3200 3.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 2.0530 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 3.2530 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 3.8930 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 3.0200 2.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 1.1620 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 1.6220 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -0.9530 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -0.4400 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -2.8040 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -3.0950 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -1.1330 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.5300 -2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 1.5420 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 0.1130 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 1.1320 4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 2.7250 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 3.5080 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 3.6280 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -1.1810 -1.1670 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3200 -0.5320 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 -3.1220 1.1320 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4600 -0.8850 -4.8200 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2690 1.7030 1.2430 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2630 1.4850 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 5.1470 1.8540 O 0 5 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 34 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 30 31 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M CHG 1 33 -1 M CHG 1 34 1 M CHG 1 36 -1 M END