ACROSORGANICS-ZINC00057001 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.1720 1.5330 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.1050 -0.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4420 0.1290 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -0.7370 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -0.2140 -0.9530 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -1.1160 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.5630 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -1.3540 -0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -0.2280 1.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 0.5460 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 0.0880 3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -0.1380 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -0.6710 1.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5910 -1.7670 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -0.1070 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 1.0600 -0.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 2.0790 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.5300 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 2.1060 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -1.7900 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -0.6900 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 0.3710 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 1.6060 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -0.8600 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 0.8170 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -0.8460 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 0.8110 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -0.8740 -0.3380 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 M CHG 1 28 -1 M END