MMs00207729 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 66 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 1.2988 0.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5986 -1.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8979 -2.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1967 -1.4981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8968 0.7514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4949 0.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7948 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0941 -2.2467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 -2.2476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4965 -3.4476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0930 0.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0924 2.2533 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7931 3.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7926 4.5029 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7533 3.9029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5787 5.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0417 6.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5417 6.8114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0058 5.3850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3912 3.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3907 4.5038 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6905 2.2543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9893 3.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9887 4.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2875 5.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5868 4.5057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5874 3.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2886 2.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2891 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 0.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5885 0.0057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5890 -1.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6004 1.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -0.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6004 -1.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5271 1.6694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0698 1.6700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5596 -2.0994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8984 -3.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8964 1.9514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4945 1.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5038 -0.3741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2747 0.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3831 1.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6113 3.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9791 4.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4823 5.8718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8679 7.0599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1667 8.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4159 8.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7154 7.0613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6910 1.0543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9493 5.1044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2871 6.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6258 5.1061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6268 2.4061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3890 -1.4947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5894 -2.6943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7890 -1.4938 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 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 15 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 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 M END