MMs02953815 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 -0.7473 -1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0055 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5055 -2.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2527 -1.2943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2582 -3.8924 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8582 -4.9316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7582 -3.8892 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9582 -3.8892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5109 -5.1867 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7637 -6.4873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5164 -7.7847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2637 -6.4904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5109 -5.1930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0109 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7418 -3.8987 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2418 -3.9018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -2.6902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5516 -3.1567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5485 -4.6567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1209 -5.1172 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7601 -5.5409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5055 -2.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7527 -1.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7527 -1.2848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0055 -2.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7582 -3.8829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7473 1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0405 -0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5978 1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0405 0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6681 -0.5312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6649 -2.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7109 -5.1841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6659 -7.5309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5869 -6.2366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8574 -5.0552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6322 -6.7341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1527 -1.2924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5978 1.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9527 -1.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7202 -4.4851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3604 -4.9209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7962 -3.2807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7852 1.9091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1451 2.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7093 0.7047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 M END