KEYORGANICS-ZINC04053752 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 0.2570 1.4330 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 0.1490 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.6980 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -0.2670 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 1.0210 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 1.9030 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 3.1690 0.8100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 3.9540 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 5.3780 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 5.1930 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 3.7910 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 7.4940 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 8.1120 2.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0420 8.0780 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 9.6120 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 10.1870 1.1700 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 10.2720 3.2390 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 9.8460 1.6340 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 7.4410 2.9900 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0630 -2.0440 -1.3800 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0630 -2.3890 -1.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -2.7600 -1.4350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6170 2.0790 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -0.1570 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 -0.9090 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 1.3160 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 3.9990 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 3.5020 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 6.0020 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 5.3660 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 5.1530 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 5.7010 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 3.1940 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 3.8650 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 7.6190 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 7.8840 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 6.0190 1.0140 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9000 6.1480 1.9970 H 0 0 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 37 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 37 1 M END