MMs01614054 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3016 -0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 -2.2455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6084 -2.9910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9048 -2.2366 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8997 -0.7366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0089 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0179 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4977 -0.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 1.5268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 -0.7187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6939 -0.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6990 -2.2098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9851 1.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2816 2.2992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5832 1.5536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 0.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2919 -0.7008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8900 -0.6919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 0.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4880 -0.6829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1813 1.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8797 2.3081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6135 -4.4910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5964 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 0.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2696 -2.8491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7296 -1.6495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2722 -1.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6177 0.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1604 0.9577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9439 2.1411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2775 3.4991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2960 -1.9008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8941 -1.8919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3637 1.3583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5878 2.6916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4136 -4.4952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6177 -5.6910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8135 -4.4869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 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 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END