MMs00967695 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.2946 -0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2857 -2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5803 -3.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8838 -2.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8926 -0.7730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1784 -3.0306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4818 -2.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4907 -0.7883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7764 -3.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0798 -2.3036 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3744 -3.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3656 -4.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6602 -5.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6513 -6.8188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9636 -4.5765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9725 -3.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6779 -2.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6867 -0.8189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2847 -0.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2759 -2.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -0.0919 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.2582 -5.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6061 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6061 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -2.8515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5733 -4.2152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6051 1.1847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1713 -4.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9996 -3.9606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5423 -3.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3228 -5.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6510 -0.2128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9972 1.1234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3116 -2.9403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6521 -6.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2939 -5.9403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8643 -4.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 35 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 25 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END