MMs02519792 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 0.0076 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2876 -2.2566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3105 -2.2434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 -1.4868 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6057 -2.6868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0132 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 -0.5868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8933 0.7698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0264 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1961 1.2264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2037 -1.4736 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2037 -2.6736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9085 -2.2302 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9085 -1.0302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9161 -3.7301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6209 -4.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3181 -3.7433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6286 -5.9867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5065 -2.2169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8018 -1.4603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1752 -2.0635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1732 -0.9437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6732 -0.9360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4165 0.3668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6599 1.6620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1600 1.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4166 0.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 0.0322 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4913 0.7830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4837 2.2830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2952 0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2876 2.2566 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2124 2.2489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7876 2.2642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 3.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0031 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4286 -5.9928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6347 -7.1867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8285 -5.9806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2784 -1.9722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6165 0.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2547 2.7043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5547 2.6905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6837 2.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4776 3.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2837 2.2769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8905 -0.3731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7038 0.8578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4799 3.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2739 4.9565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 3.7505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 33 34 2 0 0 0 0 33 35 2 0 0 0 0 33 36 1 0 0 0 0 36 52 1 0 0 0 0 36 53 1 0 0 0 0 36 54 1 0 0 0 0 M END