REMARK  Name = BDB005626
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.458   1.067   0.266  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -1.194  -0.133   0.235  0.00  0.00    +0.061 A 
ATOM      3  C   LIG    1       -0.554  -1.287   0.721  0.00  0.00    +0.055 A 
ATOM      4  N   LIG    1       -1.218  -2.518   0.700  0.00  0.00    -0.322 N 
ATOM      5  H   LIG    1       -0.767  -3.353   1.046  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -2.488  -2.690   0.231  0.00  0.00    +0.254 A 
ATOM      7  C   LIG    1       -3.186  -1.481  -0.275  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1       -4.597  -1.668  -0.769  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1       -5.127  -0.458  -1.549  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1       -4.712   0.847  -0.879  0.00  0.00    +0.102 C 
ATOM     11  N   LIG    1       -3.268   0.852  -0.719  0.00  0.00    -0.343 N 
ATOM     12  H   LIG    1       -2.874   1.721  -0.352  0.00  0.00    +0.146 HD
ATOM     13  O   LIG    1       -3.023  -3.795   0.239  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1        0.748  -1.247   1.235  0.00  0.00    +0.031 A 
ATOM     15  C   LIG    1        1.453  -0.039   1.290  0.00  0.00    -0.028 A 
ATOM     16  C   LIG    1       -2.587  -0.273  -0.271  0.00  0.00    +0.048 A 
ATOM     17  C   LIG    1        0.835   1.118   0.806  0.00  0.00    +0.051 A 
ENDROOT
BRANCH   1  19
ATOM     18  C   LIG    1       -0.508   2.551  -1.487  0.00  0.00    +0.277 C 
ATOM     19  O   LIG    1       -1.001   2.252  -0.177  0.00  0.00    -0.494 OA
ENDBRANCH   1  19
BRANCH  15  20
ATOM     20  C   LIG    1        2.856   0.012   1.844  0.00  0.00    +0.116 C 
BRANCH  20  21
ATOM     21  N   LIG    1        3.862  -0.551   0.942  0.00  0.00    -0.310 NA
ATOM     22  H   LIG    1        3.574  -1.492   0.678  0.00  0.00    +0.122 HD
BRANCH  21  23
ATOM     23  C   LIG    1        4.128   0.236  -0.269  0.00  0.00    +0.048 C 
ATOM     24  C   LIG    1        5.040  -0.592  -1.180  0.00  0.00    +0.023 C 
ATOM     25  C   LIG    1        4.801   1.573   0.044  0.00  0.00    +0.023 C 
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  15  20
TORSDOF 4