MMs00968913 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.2969 0.7538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8949 0.7613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 0.7689 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7986 -1.4773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0910 0.7764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0302 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6891 0.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0612 0.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0616 1.2955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2554 1.1735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3079 2.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8416 2.2762 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9140 3.9644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4053 4.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0114 5.4977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1262 6.7086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6349 6.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0288 5.1754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3773 -1.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2655 -2.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5817 -3.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0096 -4.2210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1214 -3.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8053 -1.7478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3257 -5.6874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7537 -6.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0375 -0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8294 -0.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3721 -0.9095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1209 1.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6636 1.6828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4275 -0.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9701 -0.9019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4895 1.9689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3170 1.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8597 1.6979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1135 3.1568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2045 5.6266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6111 7.8063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9267 7.5163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8357 5.0465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1232 -1.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6922 -4.5672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2637 -3.5816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6947 -0.9423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3862 -7.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8960 -6.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1212 -5.0044 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 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 47 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 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END