MMs01793944 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 -0.0055 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2908 2.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5926 1.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3018 -0.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8889 2.2642 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8889 1.0642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8834 3.7642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 4.5190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1906 1.5190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 0.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4869 2.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4814 3.7737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7887 1.5285 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7887 2.7285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4979 -0.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5034 -2.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8052 -2.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1014 -2.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0960 -0.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0850 2.2833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0795 3.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3758 4.5380 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6775 3.7928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9738 4.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2756 3.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2811 2.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9848 1.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6830 2.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3867 1.5380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0469 2.0962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2864 3.4547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6395 -0.5867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3062 -1.9452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4565 -0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4664 -2.8300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8095 -4.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1429 -2.8129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6145 -0.4148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0381 4.3794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9694 5.7475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3126 4.4061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3225 1.7061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9892 0.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5816 4.5095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5772 5.7095 0.0000 H 0 0 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 49 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 49 50 1 0 0 0 0 M END