REMARK  Name = BDB014974
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.254  -1.344   0.557  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        2.379  -2.032   0.193  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1        3.520  -1.720   0.938  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1        4.748  -2.349   0.683  0.00  0.00    -0.027 A 
ATOM      5  C   LIG    1        4.820  -3.294  -0.347  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        3.683  -3.614  -1.090  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        2.464  -2.987  -0.819  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1        5.976  -1.985   1.483  0.00  0.00    +0.138 C 
BRANCH   8   9
ATOM      9  N   LIG    1        6.676  -0.876   0.869  0.00  0.00    -0.324 N 
ATOM     10  H   LIG    1        6.873  -1.022  -0.116  0.00  0.00    +0.148 HD
BRANCH   9  11
ATOM     11  C   LIG    1        6.434   0.413   1.175  0.00  0.00    +0.141 A 
ATOM     12  N   LIG    1        6.633   1.394   0.297  0.00  0.00    -0.159 NA
ATOM     13  N   LIG    1        6.297   2.508   0.963  0.00  0.00    -0.283 N 
ATOM     14  H   LIG    1        6.370   3.396   0.478  0.00  0.00    +0.188 HD
ATOM     15  C   LIG    1        5.899   2.277   2.244  0.00  0.00    +0.107 A 
ATOM     16  C   LIG    1        5.984   0.916   2.417  0.00  0.00    +0.064 A 
ENDBRANCH   9  11
ENDBRANCH   8   9
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1        0.095  -1.510  -0.271  0.00  0.00    +0.261 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.998  -0.578   0.273  0.00  0.00    +0.166 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -1.346  -1.012   1.597  0.00  0.00    -0.387 OA
ATOM     20  H   LIG    1       -0.510  -1.043   2.097  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1       -2.244  -0.618  -0.641  0.00  0.00    +0.119 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -3.313   0.335  -0.275  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1       -4.564  -0.022  -0.972  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1       -5.682   0.985  -0.800  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1       -5.412   2.301  -0.385  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1       -6.461   3.221  -0.259  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -7.768   2.847  -0.569  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -8.037   1.550  -1.000  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -4.006   2.693  -0.014  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1       -7.000   0.624  -1.117  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1       -2.956   1.728  -0.580  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 9