MMs02582495 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -1.5000 -0.0011 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2491 -1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4982 -2.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0018 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7509 -1.2985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4664 -4.0243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7465 -4.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9607 -4.0261 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8933 -4.4868 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0448 -5.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3578 -5.9131 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9578 -6.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8578 -5.9120 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0578 -5.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3203 -4.4851 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6309 -3.3260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1062 -3.6043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7466 -4.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0574 -2.5531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1984 -2.1815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7404 -7.1249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2531 -8.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -7.1273 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7491 -1.3017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7509 1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2509 1.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -0.0064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5993 1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7457 -6.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9144 -5.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9459 -4.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3483 -2.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3727 0.4080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7092 1.1784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7908 -1.1859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1273 -0.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6236 1.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9601 2.4759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0018 2.5917 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 31 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 25 26 1 0 0 0 0 25 35 1 0 0 0 0 26 27 1 0 0 0 0 26 36 1 0 0 0 0 26 37 1 0 0 0 0 27 28 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 28 29 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 29 30 2 0 0 0 0 29 42 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 42 -1 M END