MMs02413885 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 37 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 -0.6380 1.3576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5620 1.3576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1263 1.1703 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4081 -0.3030 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0940 -1.0263 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9067 -2.5146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9047 -0.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5663 1.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 1.2435 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2630 1.2435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7246 2.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2212 2.6898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1991 -1.5775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0853 2.6717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6912 3.9551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5849 2.7023 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3082 4.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8079 4.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5843 2.7637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0267 0.6211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7251 -0.9562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9473 2.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7757 -1.3959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0572 -0.5371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4138 1.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6953 2.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6326 -2.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2061 1.6756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1724 4.4037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4924 5.2022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8895 3.8358 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.8980 -0.0026 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.8949 0.6654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5661 -0.9995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9012 -0.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5312 5.3612 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 14 28 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 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 M CHG 1 32 -1 M CHG 1 33 1 M CHG 1 37 -1 M END