MMs01056029 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 -1.1396 -0.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5541 -0.4761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6937 -1.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4188 -2.9261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0043 -3.4253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8647 -2.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -4.9248 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0893 -5.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4798 -5.3523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3307 -4.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8302 -4.0793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0469 -2.7241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7640 -1.4066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2635 -1.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9806 -0.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4801 -0.0137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2625 -1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5454 -2.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0459 -2.6487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7621 -1.2558 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.9791 -6.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0037 -7.9064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7803 -0.9117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9117 0.7803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7803 0.9117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 0.7036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8253 -1.0521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2669 -2.8493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6516 -5.2660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9678 -4.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1845 -3.1061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8683 -3.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6264 -1.0247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9426 -0.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3547 0.9724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0538 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1714 -3.6348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4722 -3.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5473 -2.7618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9214 -1.7380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4537 -7.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8531 -8.1733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M END