MMs02020251 MOE2007 2D CORINA 3.40 0006 02.08.2006 23 24 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 1.5000 0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2563 -1.2880 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5127 -2.5907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7563 -1.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 -0.0629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2557 1.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0609 -0.5195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3562 0.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6589 -0.5068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6662 -2.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3709 -2.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 -2.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6439 -2.4899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3782 -4.2631 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0059 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0059 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2858 1.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6256 0.4232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3504 1.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6952 0.0983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7084 -2.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 M END