KEYORGANICS-ZINC04105270 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 0.3740 1.8470 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 1.7460 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 0.7640 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -0.1160 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -0.0150 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 0.9680 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -0.9560 -2.2250 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7600 -0.9480 -3.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -1.7390 -2.2670 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5610 -1.3660 0.0160 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -1.1370 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -2.5950 -0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 -1.0900 -1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 0.1670 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3930 0.0340 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 0.3630 -3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 0.2410 -4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 -0.2110 -4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6430 -0.5400 -2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6490 -0.4120 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2190 -1.1060 -2.5360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 0.6530 -6.3280 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 2.6110 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 2.4330 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 0.6850 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 1.0470 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -1.7600 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 0.9730 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 0.3930 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 0.7160 -4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1570 -0.3070 -5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 -0.6640 -1.0080 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 32 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END