MMs01046770 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 1.3026 0.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 0.7314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9078 2.2314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2104 2.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5058 2.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4987 0.7190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8084 2.9628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1039 2.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0967 0.7067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4065 2.9505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4136 4.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7162 5.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0117 4.4381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0045 2.9381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7019 2.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6948 0.6943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2928 0.6819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3000 2.1819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9831 -1.5619 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0421 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5356 1.6667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0783 1.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8714 2.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2161 4.1752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5351 0.1141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1904 -1.2247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8141 4.1628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2309 4.2477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0086 5.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9493 6.1172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4919 6.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6527 0.0993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3292 0.0770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3421 2.7769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 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 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END