MMs00552052 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 0.0016 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3014 -2.2486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5996 -1.4973 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -2.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -3.7459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1977 -1.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4975 -2.2432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 -1.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4944 0.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0925 0.7595 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2967 -2.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5965 -1.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8948 -2.2541 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1946 -1.5054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4928 -2.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7927 -1.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 0.7432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 0.7405 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0013 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5984 -0.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4988 -3.4432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8356 -2.0908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4932 1.9568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1563 0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2954 -3.4514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3026 -3.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8935 -3.4541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4916 -3.4568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8313 -2.1092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4972 1.9432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1575 0.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 14 2 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END