MMs01076363 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 -0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2516 1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7516 1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7484 -1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2484 -1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4968 -2.5999 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7484 -1.3074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7516 1.2906 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2516 1.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0032 2.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5032 2.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2516 1.2850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7516 1.2832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5032 2.5813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0032 2.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7516 1.2794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2516 1.2775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0000 -0.0224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0032 2.5756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4952 2.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8089 4.1974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5108 4.9490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3948 3.9467 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0015 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6529 2.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3529 2.3328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3471 -2.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1529 2.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4045 3.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1045 3.6235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0987 -1.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3987 -1.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3761 2.9931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7131 3.7628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7963 3.7614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1314 2.9884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1271 -0.4305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7901 -1.2002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3718 -0.4258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7069 -1.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2970 1.8378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9058 4.6841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3868 6.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 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 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 M END