MMs01186844 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 1.3004 -0.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3032 -2.2476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0055 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0083 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3087 -5.2476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6064 -4.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6036 -2.9952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9068 -5.2428 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2045 -4.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5049 -5.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6644 -6.7295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1322 -7.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8798 -5.7382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8741 -4.6254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3713 -5.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2552 -6.7906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9789 -4.2072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4704 -4.0477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0779 -2.6762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5694 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1770 -1.1453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2893 -5.2524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2866 -6.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5842 -7.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8846 -6.7572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8874 -5.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5898 -4.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5981 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0403 0.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5981 -1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3004 0.4524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -1.0333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6362 0.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9962 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0348 -2.4019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4314 -3.5726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9741 -3.5697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -7.5341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6223 -8.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2717 -3.2377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3889 -5.2449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6353 -4.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9131 -2.3881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1594 -1.4790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2742 -1.6313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6631 -0.0481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0799 -0.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1052 -6.5418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8741 -7.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8112 -8.4226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3539 -8.4255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0688 -5.4677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2999 -4.1303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8201 -3.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3628 -3.5870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END