MMs01847963 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 1.1082 -1.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9419 -2.5016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3082 -3.1205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3191 -2.0122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5774 -0.7084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0726 0.3847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6107 -4.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5998 -5.6979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3415 -7.0018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8107 -6.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -5.2086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1323 -4.2518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5385 -4.7739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6937 -3.8171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4428 -2.3383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 -1.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0042 -1.9036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2552 -3.3824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0999 -4.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6614 -3.9045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7265 -7.8873 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8087 0.8866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8866 0.8087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8087 -0.8866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1012 -3.0949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7393 -5.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3178 -1.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3972 -0.1984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9284 -1.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3007 -5.5223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5856 -3.1391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2699 -8.9970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 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 22 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 27 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 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 M END