ACROSORGANICS-ZINC04261854 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8390 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1520 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1050 -0.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7630 -1.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.2120 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -3.1680 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -4.2610 -3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -5.3990 -3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -5.4460 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -4.3540 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.2690 1.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.4330 2.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.3080 3.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -0.9000 4.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.4610 5.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.8650 6.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.0730 7.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -1.4240 7.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -1.8470 5.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -2.6080 8.3530 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -2.7830 8.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -3.6780 7.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 2.3080 6.6540 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0160 3.1360 5.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 2.6680 7.8180 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -2.2800 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -4.2280 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -6.2520 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -6.3350 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -4.3890 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -3.6060 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 1.1970 4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.2520 8.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -3.1740 5.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -1.9690 9.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.5400 10.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -3.5500 5.3490 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 42 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END