MMs01339784 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -0.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2454 -1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4909 -2.6033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0091 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7545 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2545 -1.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1405 -2.5016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5654 -2.0330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5602 -0.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -0.0745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6634 1.3504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7706 0.3529 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1430 -0.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3535 0.6335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1914 2.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7259 0.0282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8879 -1.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2604 -2.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4708 -1.1824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3088 0.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9363 0.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7454 -1.3122 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5964 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1036 1.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0872 -3.6446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6127 -3.6352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4633 2.2450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4888 1.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4755 -1.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0092 -1.0830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6906 -1.3835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6017 -2.6284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5928 -3.0655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1265 -2.8989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5061 0.2293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5950 1.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0702 1.7447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6039 1.9113 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 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 22 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END