MMs02587073 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.2965 -0.7544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2914 -2.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6032 1.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9048 2.2367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2012 1.4823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 -0.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5028 2.2279 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7993 1.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1009 2.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3974 1.4646 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6989 2.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9954 1.4557 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2970 2.2013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5935 1.4469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8951 2.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9002 3.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6037 4.4469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3021 3.7013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0056 4.4557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7040 3.7102 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0107 5.9557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6035 1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0372 0.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6035 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0914 -2.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2873 -3.4544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4914 -2.2585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 2.0947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9088 3.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2333 -0.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8904 -1.9633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5069 3.4279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3327 3.1409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8754 3.1356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5894 0.2469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9322 1.5889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9414 4.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6078 5.6469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9736 6.5593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 43 1 0 0 0 0 M END