MMs01085469 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 43 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 1.4858 -0.2057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0506 -1.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5365 -1.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4575 -0.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 0.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4069 0.9783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0398 1.7392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7269 -1.4269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3135 0.9469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9536 -0.5093 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7031 1.5117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8870 0.5907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2766 1.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4606 0.2344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2549 -1.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4388 -2.1724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8284 -1.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0341 -0.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8502 0.7992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0558 2.2851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8719 3.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4823 2.6413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2984 3.5623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9088 2.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7248 3.9186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0124 -2.5287 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1645 1.1887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1887 0.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1645 -1.1887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3138 -2.5424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9883 -2.9126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 2.0899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7225 -0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1432 -1.7032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2743 -3.3611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1458 0.3300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1675 2.7369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0364 4.3948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 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 7 33 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M END