OTAVA-ZINC01056921 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 1.9800 0.7320 1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -0.1460 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 0.2560 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.5410 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 2.4310 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 2.0320 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 2.9750 3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 3.6460 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 3.3400 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 4.1220 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 5.5540 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 6.2290 1.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 6.0580 0.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 5.2600 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 5.5860 -0.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 3.6380 -0.0510 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 7.4190 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 7.8550 1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 9.1940 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 10.1040 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 9.6700 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 8.3290 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 11.4230 1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 4.8840 3.6550 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -0.6930 -0.6240 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0760 -1.8240 -0.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -0.3430 -1.2810 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8320 0.4150 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -1.1500 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 1.8470 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 3.4330 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 3.1320 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 2.4860 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4960 7.1460 2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0350 9.5340 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 10.3780 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 7.9900 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 11.6800 0.8100 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END