MMs01725986 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.1311 -0.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2376 -2.1901 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3624 -3.2293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1074 -3.4122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5385 -2.9626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1180 -3.1178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5531 -1.4626 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9881 -4.3936 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9881 -5.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5571 -4.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8631 -6.1730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5838 -4.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5199 -2.7842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1418 -2.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7474 -0.7447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6324 0.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1311 0.5303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1148 -0.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8426 -2.0768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2623 -2.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0249 -3.4672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4954 0.4698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7882 0.9049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9049 0.7882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7882 -0.9049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6477 -4.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0332 -2.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9428 -2.2424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2182 -1.0274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -0.2917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5302 0.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8496 1.6466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8146 1.6878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1892 1.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8228 0.3672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2169 -1.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1587 -3.2344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0415 -2.0263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0775 0.3241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7869 1.6339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3314 0.7613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3179 -5.0876 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9996 -0.8692 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 21 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 43 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 43 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 44 -1 M END