ACROSORGANICS-ZINC04261854 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.9810 1.1070 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -0.3200 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -1.1480 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.3920 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -2.2570 -0.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -0.9800 -0.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -3.2190 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -2.8310 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -3.7400 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -5.0450 -3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -5.4410 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -4.5340 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -3.5280 1.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.7520 2.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -1.3840 3.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -0.8870 4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 0.4560 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 0.9420 6.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 0.1030 7.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -1.2310 7.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -1.7350 5.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -2.3040 8.5190 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -1.6860 9.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -3.5820 7.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 2.3470 6.5560 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6040 3.0670 5.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 2.7330 7.7320 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1940 1.7080 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 1.5080 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 1.2310 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -1.8180 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -3.4270 -4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -5.7540 -4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -6.4600 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.8970 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -3.3210 2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 1.1070 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 0.4550 8.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -3.0550 5.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -2.2000 9.3280 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0310 -3.5070 6.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 39 41 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M CHG 1 40 -1 M END