ACROSORGANICS-ZINC04261794 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.3040 1.2680 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -0.1120 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -0.7310 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 0.0120 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 1.3920 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 2.0330 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 3.4280 -0.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 3.9720 0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 5.3500 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 5.8960 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 7.2740 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 8.1500 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 9.5290 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 10.3930 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 9.9120 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 8.5470 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 7.6370 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 6.2400 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 5.7440 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 8.1130 -0.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 12.1530 -0.6170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 12.6700 0.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 12.2280 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 4.8150 0.4350 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 4.0620 1.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 4.0610 -0.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -2.1720 -0.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1410 -2.7460 0.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -2.7410 -0.9740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5390 1.7530 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -0.6790 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -0.4500 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 1.9870 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 7.6650 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 9.9370 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 10.5880 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 4.7690 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 7.1360 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 12.5310 -1.5550 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4720 5.7310 0.6080 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M CHG 1 39 -1 M CHG 1 40 -1 M END