MMs01174163 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 1.5000 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 3.7522 -1.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7478 1.3055 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 6.0000 0.0103 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7522 -1.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0044 -2.5878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2522 -1.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0044 -2.5827 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5044 -2.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2567 -3.8779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7566 -3.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5044 -2.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7522 -1.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2522 -1.2798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0231 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.5089 -5.1730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7611 -6.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0089 -5.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7611 -6.4682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2611 -6.4657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0089 -5.1653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2566 -3.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7566 -3.8702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0021 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -2.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -2.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 2.3457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 2.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5982 1.0505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0418 -0.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3791 -0.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7044 -2.5729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7208 -5.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1629 -7.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8014 -7.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4089 -6.2097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6342 -6.8806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9715 -7.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0547 -7.6478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3894 -6.8742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9294 -5.9351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9268 -4.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3836 -3.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0462 -2.6862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6283 -3.4617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9630 -2.6880 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 32 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 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END