MMs00723280 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 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 1.5000 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2506 1.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7506 1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5011 2.5961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0011 2.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7506 1.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2506 1.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0011 2.5941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2517 3.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7517 3.8942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5011 2.5935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2517 3.8922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2506 1.2941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7506 1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5011 2.5922 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7494 -1.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2494 -1.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0000 -0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2506 1.2915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7506 1.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0011 2.5902 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.5000 -0.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9989 -2.6060 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0005 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0005 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2911 -1.1823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6275 -0.4116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1231 1.7090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4595 2.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5417 0.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 0.8865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1501 0.2571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8501 0.2559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8522 4.9325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1522 4.9336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6501 0.2551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8995 -1.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1490 -2.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1510 2.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0995 -1.0480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 43 1 0 0 0 0 25 44 1 0 0 0 0 M END