KEYORGANICS-ZINC04053185 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.6360 -0.0160 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -1.3080 0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.6560 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -0.7710 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -1.1340 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -2.3900 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -3.2690 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -2.9060 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -3.7700 0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -5.0340 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -2.7260 4.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 -3.5930 4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 -1.8730 5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 -2.3550 6.3070 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -0.6580 5.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -0.2220 4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 0.2170 6.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -0.2410 7.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -1.0400 8.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -1.4600 9.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -1.0830 9.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -0.2850 8.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 0.1410 7.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 1.1500 6.6560 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 0.7490 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 0.1340 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 0.0560 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 0.1950 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -4.2360 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -5.6270 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -4.8770 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -5.5630 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 0.1750 6.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 1.2410 6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -1.3350 8.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -2.0840 10.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -1.4130 10.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.0090 9.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 0.9570 4.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 1.5820 5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 39 2 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 39 40 1 0 0 0 0 M END