IBS-ZINC05201139 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2180 -0.6720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 0.0430 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 1.4430 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 2.1020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 1.9930 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 3.1930 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 1.1300 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -0.3950 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -1.0000 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -0.9860 -1.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 1.4570 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 1.6850 1.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5320 0.7960 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1820 2.1090 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 3.1310 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 3.4860 2.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 2.8360 1.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4280 3.6340 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3200 4.5800 4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4570 5.0460 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7030 4.5770 4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8170 3.6390 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6870 3.1610 2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1290 5.1680 5.2680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.8990 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -1.7510 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 3.1820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 0.6330 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 2.3620 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8230 1.2580 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 2.5630 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3490 4.9460 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3740 5.7780 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7910 3.2780 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7770 2.4260 2.0440 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END