MMs00640079 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 1.5000 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 1.3064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 1.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7457 1.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9915 2.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4915 2.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2457 1.3260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9914 2.6275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4914 2.6324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2457 1.3359 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2372 3.9339 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7372 3.9388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4914 2.6423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9914 2.6472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7372 3.9487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9829 5.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4829 5.2403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2371 3.9536 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0039 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0039 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2955 -1.1775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -0.4018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -1.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6034 -1.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5881 3.6589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8881 3.6501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3880 3.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6338 4.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8948 1.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5948 1.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5795 6.2864 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 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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