REMARK  Name = BDB022420
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.537  -0.772   1.418  0.00  0.00    -0.018 A 
ATOM      2  C   LIG    1        1.275  -0.935   0.817  0.00  0.00    +0.013 A 
ATOM      3  C   LIG    1        0.158  -1.374   1.551  0.00  0.00    -0.035 A 
ATOM      4  C   LIG    1        0.320  -1.640   2.917  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        1.563  -1.485   3.529  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        2.663  -1.060   2.784  0.00  0.00    +0.008 A 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        5.922   0.586  -0.872  0.00  0.00    +0.034 A 
ATOM      8  C   LIG    1        4.762   1.363  -0.782  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1        3.660   0.920  -0.039  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1        3.691  -0.308   0.634  0.00  0.00    -0.018 A 
ATOM     11  C   LIG    1        4.859  -1.078   0.539  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1        5.961  -0.638  -0.206  0.00  0.00    +0.024 A 
BRANCH   7  14
ATOM     13  C   LIG    1        8.213   0.516  -1.875  0.00  0.00    +0.241 C 
ATOM     14  N   LIG    1        6.987   1.105  -1.639  0.00  0.00    -0.282 N 
ATOM     15  H   LIG    1        6.819   2.010  -2.055  0.00  0.00    +0.155 HD
ATOM     16  O   LIG    1        8.606  -0.570  -1.472  0.00  0.00    -0.271 OA
BRANCH  13  18
ATOM     17  C   LIG    1       10.313   0.975  -3.076  0.00  0.00    +0.013 C 
ATOM     18  C   LIG    1        9.084   1.378  -2.729  0.00  0.00    +0.060 C 
ENDBRANCH  13  18
ENDBRANCH   7  14
ENDBRANCH   1  10
BRANCH   3  19
ATOM     19  C   LIG    1       -1.182  -1.558   0.854  0.00  0.00    +0.102 C 
ATOM     20  C   LIG    1       -1.709  -2.990   0.998  0.00  0.00    +0.022 C 
BRANCH  19  21
ATOM     21  C   LIG    1       -2.267  -0.560   1.301  0.00  0.00    +0.225 C 
ATOM     22  N   LIG    1       -3.236  -0.396   0.320  0.00  0.00    -0.268 N 
ATOM     23  H   LIG    1       -3.140  -0.899  -0.547  0.00  0.00    +0.156 HD
ATOM     24  O   LIG    1       -2.249  -0.030   2.407  0.00  0.00    -0.275 OA
BRANCH  22  25
ATOM     25  C   LIG    1       -4.355   0.408   0.421  0.00  0.00    +0.150 A 
ATOM     26  C   LIG    1       -5.331   0.549  -0.616  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1       -5.343  -0.094  -1.952  0.00  0.00    +0.049 C 
ATOM     28  C   LIG    1       -6.263   1.414  -0.083  0.00  0.00    +0.044 A 
ATOM     29  N   LIG    1       -5.816   1.748   1.157  0.00  0.00    -0.279 N 
ATOM     30  H   LIG    1       -6.242   2.372   1.833  0.00  0.00    +0.189 HD
ATOM     31  N   LIG    1       -4.669   1.146   1.484  0.00  0.00    -0.158 NA
BRANCH  28  32
ATOM     32  C   LIG    1       -7.553   1.941  -0.751  0.00  0.00    +0.038 C 
ATOM     33  C   LIG    1       -8.646   0.964  -1.095  0.00  0.00    +0.010 C 
ATOM     34  C   LIG    1       -8.839   1.935   0.033  0.00  0.00    +0.010 C 
ENDBRANCH  28  32
ENDBRANCH  22  25
ENDBRANCH  19  21
ENDBRANCH   3  19
TORSDOF 7