MMs01426822 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.5000 -0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2519 1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7519 1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7481 -1.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2481 -1.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2481 -1.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9961 -2.6114 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5961 -3.6507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2442 -3.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7442 -3.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9923 -5.2051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7404 -6.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2403 -6.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9923 -5.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4961 -2.6137 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2481 -1.3157 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.5460 -2.0677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9501 -0.5638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -0.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3919 1.3534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5081 2.3555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8060 1.6035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4920 0.1368 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.1773 2.2116 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0018 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0018 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6535 2.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3535 2.3318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3465 -2.3447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6465 -2.3407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7934 1.1732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1282 0.3998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3763 -0.9025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0414 -0.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -2.8670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7923 -5.2033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1388 -7.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8388 -7.5475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1923 -5.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0946 -3.6538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2185 1.6046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3845 3.5491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7481 -1.3091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1465 -2.3474 0.0000 H 0 0 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 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 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 47 48 1 0 0 0 0 M END