MMs01585597 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7475 -1.3005 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3475 -0.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2475 -1.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9951 -2.6038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0057 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2475 -1.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7475 -1.3119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7525 1.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2525 1.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5049 2.5838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0049 2.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7525 1.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0049 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5049 -2.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2525 -1.2948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2574 -3.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5099 -5.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2623 -6.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7623 -6.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5099 -5.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7574 -3.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5049 -2.5895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5148 -7.7857 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0404 0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6455 -2.3471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3455 -2.3522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6544 2.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7988 3.7631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1333 2.9892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6732 2.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6702 0.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3099 -5.1956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6643 -7.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7099 -5.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7049 -2.5872 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 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 M END