REMARK  Name = BDB029509
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        6.769   0.948  -1.453  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1        5.668   0.660  -0.992  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1        4.536   0.737  -1.763  0.00  0.00    -0.256 N 
ATOM      4  H   LIG    1        4.707   0.943  -2.739  0.00  0.00    +0.157 HD
ATOM      5  C   LIG    1        3.320   0.153  -1.498  0.00  0.00    +0.227 C 
ATOM      6  O   LIG    1        2.521  -0.040  -2.409  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1        3.037  -0.162  -0.031  0.00  0.00    +0.065 C 
ATOM      8  C   LIG    1        1.857  -1.132   0.122  0.00  0.00    +0.124 C 
ATOM      9  N   LIG    1        0.683  -0.298   0.337  0.00  0.00    -0.300 N 
ATOM     10  C   LIG    1       -0.582  -0.856   0.308  0.00  0.00    +0.223 C 
ATOM     11  O   LIG    1       -0.728  -2.078   0.239  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        1.033   1.107   0.392  0.00  0.00    +0.109 C 
ATOM     13  C   LIG    1        2.530   1.108   0.678  0.00  0.00    +0.036 C 
ATOM     14  C   LIG    1        4.317  -0.731   0.589  0.00  0.00    +0.027 C 
ATOM     15  C   LIG    1        5.478   0.242   0.445  0.00  0.00    +0.097 C 
ENDROOT
BRANCH  10  16
ATOM     16  C   LIG    1       -1.778   0.101   0.424  0.00  0.00    +0.105 C 
ATOM     17  C   LIG    1       -2.953  -0.275  -0.474  0.00  0.00    -0.032 A 
ATOM     18  C   LIG    1       -4.281  -0.202  -0.010  0.00  0.00    -0.043 A 
ATOM     19  C   LIG    1       -5.338  -0.522  -0.878  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -5.090  -0.877  -2.202  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -3.782  -0.919  -2.674  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -4.603   0.162   1.418  0.00  0.00    +0.035 C 
ATOM     23  C   LIG    1       -3.472   0.922   2.103  0.00  0.00    +0.006 C 
ATOM     24  C   LIG    1       -2.723  -0.615  -1.820  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -2.155   0.184   1.912  0.00  0.00    +0.018 C 
ENDBRANCH  10  16
TORSDOF 1