MMs00727231 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 1.2944 -0.7579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8925 -0.7737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -2.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4905 -0.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8032 1.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5088 2.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2052 1.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1068 2.1945 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4013 1.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.7048 2.1787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9993 1.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2846 -0.8371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5973 1.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3029 2.1628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8826 -0.8529 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6063 1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0356 0.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6063 -1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5175 -1.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0602 -1.6818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4832 -1.9896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8296 -0.6538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5161 3.4103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1696 2.0746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1141 3.3945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7122 3.3787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9473 -0.6729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2773 -2.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6402 1.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 M END