MMs01571929 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.2953 -0.7564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -0.7692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2035 1.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 2.2308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6054 1.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5062 2.2180 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7626 3.5207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2498 0.9153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8089 2.9616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 2.2052 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1042 3.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0969 0.7052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7655 0.5521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7637 -0.5675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9577 -0.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0073 -1.8628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5416 -1.5437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5324 -2.6535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9889 -4.0824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4546 -4.4014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4638 -3.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4070 2.9488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7023 2.1924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 -1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8875 -1.9692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2324 -0.6307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9141 3.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5692 2.0923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8148 4.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9161 0.9194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6809 -0.4204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0208 1.7247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3599 -2.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1816 -4.9702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8198 -5.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6363 -3.5470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4144 4.4487 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 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 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 M CHG 1 43 -1 M END