MMs02165317 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 54 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 0.7508 -1.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2508 -1.2976 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6508 -0.2584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0016 -2.5962 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6016 -1.5570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2525 -3.8957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7525 -3.8966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5016 -2.5952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2525 -3.8938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5033 -5.1933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7525 -3.8929 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1525 -2.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5033 -5.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7541 -6.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0033 -5.1905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5016 -2.5934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0016 -2.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7525 -3.8910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7508 -1.2929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2508 -1.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2492 1.3061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9984 2.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4984 2.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2492 1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0389 0.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6007 1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0389 -0.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3766 -1.7097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9599 -2.4802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0396 -0.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5993 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9604 0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 -1.5556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1033 -6.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7145 -5.8916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1547 -7.5305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7937 -7.0903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0040 -6.3905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2033 -5.1897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0025 -3.9905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 -1.5545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0432 -2.4739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3787 -1.7017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0492 1.3054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3977 3.6445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0977 3.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4492 1.3088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1007 -1.0304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0033 -5.1943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4039 -6.2339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 53 1 0 0 0 0 10 11 1 0 0 0 0 10 37 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 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 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 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M END