ACROSORGANICS-ZINC02159505 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.1300 1.2340 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.0870 1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.3750 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -1.6500 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.7460 0.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -1.5060 -0.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -2.3660 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -0.2880 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 0.8730 -0.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 0.7670 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 1.8010 0.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 3.2140 0.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4360 3.3680 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 3.6900 -0.9060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9020 3.2860 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 5.1870 -0.7320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2700 5.7090 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 5.3110 0.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7620 6.0750 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 4.0300 1.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 5.5940 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 6.1030 0.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 7.3920 0.5000 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 6.9040 -0.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 5.7110 -0.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 5.2080 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 3.4100 -1.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 2.4490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 -0.3510 -1.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 1.8300 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 6.3190 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 4.6780 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 -1.2160 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 0.5140 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 7.6360 1.7770 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7170 8.5040 0.1540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 11 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 10 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 29 33 1 0 0 0 0 29 34 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END