MMs00621736 MOE2007 2D CORINA 3.40 0006 02.08.2006 29 30 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 1.2974 0.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8954 0.7586 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9347 1.3586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8921 2.2586 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5914 3.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5881 4.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2941 2.2529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3562 -1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8241 -1.7886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5713 -0.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5651 0.6246 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0627 -0.3278 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.6014 -1.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 -2.2414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -2.2471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3073 -3.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6023 -1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 2.8609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2535 2.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4662 -2.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3146 -2.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1073 -3.7498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -4.9471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5073 -3.7445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 27 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 M END