ACROSORGANICS-ZINC00057096 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 1 0 0 0 0 0999 V2000 0.0450 1.4570 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0730 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5420 -0.4220 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.6650 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.3240 2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -0.6400 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.7690 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.5450 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -0.7470 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -1.1090 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -1.2770 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -1.5030 0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -1.1230 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 -1.3120 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -1.1480 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -0.8120 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -0.6700 4.8120 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -1.3230 4.8920 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 -1.3330 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -0.3740 -3.3970 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0770 1.8230 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 1.8560 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.8780 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -1.7590 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -0.2860 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.5880 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -1.5790 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -2.4700 -2.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 16 2 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 M CHG 1 20 -1 M END