MMs01639587 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3032 -0.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3115 -2.2427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6147 -2.9855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9096 -2.2283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -0.7283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3446 1.5216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 1.8416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5672 0.5468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5698 -0.5735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0599 0.3983 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9348 1.6167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.5348 2.6559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3171 2.9836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4274 1.4682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0451 0.1013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3023 2.6866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7950 2.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4127 1.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9053 1.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7802 2.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1625 3.6081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6699 3.7566 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2728 2.0927 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6231 -4.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5942 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 0.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5942 -1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2757 -2.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9521 -2.8225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5914 1.2144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4106 3.4778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8229 4.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2235 2.4894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8081 3.7801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7128 0.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3995 -0.0708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8624 4.5828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4231 -4.4921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6298 -5.6854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8231 -4.4788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 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 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 M END