MMs00026757 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 57 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 -1.5000 0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2522 -1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5045 -2.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7478 -1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9955 -2.6032 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4955 -2.6058 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8955 -3.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2478 -1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7477 -1.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4955 -2.6110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7433 -3.9088 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1433 -4.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2433 -3.9062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 -5.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9910 -5.2117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7388 -6.5068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4865 -7.8072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7343 -9.1049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4821 -10.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9821 -10.4078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7298 -11.7030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5298 -11.7009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 -12.7432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9955 -2.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7433 -3.9139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7477 -1.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2477 -1.3184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -0.0207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2477 -1.3236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7522 -1.2926 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0982 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1063 -3.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5937 -3.6383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0414 -0.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3761 -0.8944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 -0.8957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4582 -0.1267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5414 -0.1286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8761 -0.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1149 -4.3146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4496 -5.0883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5388 -6.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4071 -7.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4045 -8.5801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8164 -8.3320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8137 -9.8747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6208 -0.9035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9582 -0.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8731 0.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2104 1.1607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2522 1.2745 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 27 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 45 1 0 0 0 0 16 46 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 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 M CHG 1 56 -1 M END