MMs02682639 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 0.0082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2429 1.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4858 2.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2286 3.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7286 3.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4857 2.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7428 1.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4715 5.2207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6715 5.2273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 6.5156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4573 7.8188 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2144 6.5074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4715 5.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0285 5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7856 6.4910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2855 6.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0426 7.7777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5426 7.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2855 6.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5284 5.1714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0284 5.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7855 6.4581 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2858 2.5997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6857 2.6292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0065 -1.1671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1999 0.0394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9933 1.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6228 4.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3398 6.9076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0004 7.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4483 8.8202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1483 8.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1227 4.1289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4227 4.1437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 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 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 M END