MMs01326514 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 1.3018 -0.7453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3072 -2.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 -2.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9053 -2.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8998 -0.7358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5926 1.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4979 -0.7264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5033 -2.2264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 -0.7169 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6940 -0.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6994 -2.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0012 -2.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2975 -2.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2921 -0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9848 1.5472 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6831 2.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3868 1.5378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5962 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5962 -1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2702 -2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6133 -4.1905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9467 -2.8320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7926 1.5138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5882 2.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3926 1.5051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1918 1.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0195 0.9448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 0.9504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6624 -2.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0056 -4.1527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3389 -2.7942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3291 -0.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6787 3.4925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 M END