MMs02557147 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 -0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2522 1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5043 2.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7478 1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9957 2.6031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4956 2.6056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2435 3.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4913 5.2037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7435 3.9084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6272 2.6963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0530 3.1623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0505 4.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6231 5.1234 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.2625 5.5460 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7522 1.2928 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7497 -0.2072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7547 2.7928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2522 1.2903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2522 1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5043 2.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0043 2.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6017 -1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0983 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1061 3.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5939 3.6383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3939 3.6413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0974 1.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 1.5545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 2.4585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8717 -0.4186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2064 -1.1921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2896 -1.1940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6269 -0.4248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1701 0.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1727 2.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6326 2.9941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2979 3.7676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8774 3.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2147 3.7695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 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 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END