MMs00548965 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 31 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 0.7437 -1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9873 -2.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -3.9080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -3.9007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0126 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5126 -2.5907 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2020 -3.7499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8245 -3.3295 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8637 -2.7295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8172 -1.8295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3884 -1.3729 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0423 -4.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4097 -3.5885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9747 -5.2107 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4746 -5.2180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2184 -6.5061 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0421 0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0421 -0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8487 -0.2737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1873 -2.6185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -4.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0112 -1.9491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -0.6545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4002 -3.8000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0349 -4.9430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8928 -5.6978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 -6.3984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END