MMs00397031 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 44 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 0.7455 1.3016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0089 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5089 2.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2544 1.2913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7227 1.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9332 0.7123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3056 1.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4675 2.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 3.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8846 3.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5164 3.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8399 3.4143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0504 2.5285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8885 1.0373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4228 3.1339 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.5743 3.9824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9133 4.5873 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.5133 5.6265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2110 4.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3904 4.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9920 3.9405 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.8405 3.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4811 2.6683 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.8811 1.6291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0480 1.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5341 1.0761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2209 5.7839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9455 1.3057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5875 3.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0964 -1.0464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8037 -0.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2740 0.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3866 4.8878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9695 4.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3578 5.9136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5888 4.2318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1287 0.0943 0.0000 O 0 5 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 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 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 40 -1 M END