REMARK  Name = BDB051625
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.680  -0.578  -0.097  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -1.141  -1.318   0.962  0.00  0.00    +0.025 A 
ATOM      3  C   LIG    1        0.233  -1.287   1.241  0.00  0.00    +0.029 A 
ATOM      4  C   LIG    1        1.090  -0.508   0.456  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1        0.551   0.233  -0.605  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1       -0.823   0.196  -0.877  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        2.491  -0.455   0.713  0.00  0.00    -0.239 N 
ATOM      8  N   LIG    1        3.307   0.311  -0.069  0.00  0.00    -0.166 NA
ATOM      9  C   LIG    1        4.553   0.152   0.420  0.00  0.00    +0.105 A 
ATOM     10  C   LIG    1        4.495  -0.746   1.543  0.00  0.00    +0.021 A 
ATOM     11  C   LIG    1        5.549  -1.182   2.337  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1        6.772  -0.625   1.914  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        6.894   0.272   0.808  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        5.793   0.695   0.018  0.00  0.00    +0.064 A 
ATOM     15  C   LIG    1        3.189  -1.111   1.704  0.00  0.00    +0.123 A 
BRANCH  14  16
ATOM     16  C   LIG    1        5.974   1.621  -1.112  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1        7.081   2.054  -1.406  0.00  0.00    -0.270 OA
ATOM     18  N   LIG    1        4.862   1.976  -1.816  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1        4.954   2.612  -2.595  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1        3.943   1.616  -1.567  0.00  0.00    +0.145 HD
ENDBRANCH  14  16
ENDBRANCH   4   7
BRANCH   1  22
ATOM     21  C   LIG    1       -3.831  -0.017  -1.267  0.00  0.00    +0.231 C 
ATOM     22  N   LIG    1       -3.072  -0.670  -0.304  0.00  0.00    -0.284 N 
ATOM     23  H   LIG    1       -3.578  -1.257   0.346  0.00  0.00    +0.155 HD
ATOM     24  O   LIG    1       -3.408   0.766  -2.113  0.00  0.00    -0.274 OA
BRANCH  21  25
ATOM     25  C   LIG    1       -5.324  -0.380  -1.186  0.00  0.00    +0.180 C 
BRANCH  25  27
ATOM     26  C   LIG    1       -5.784   0.799   0.907  0.00  0.00    +0.105 C 
ATOM     27  N   LIG    1       -6.110   0.673  -0.512  0.00  0.00    -0.300 NA
ATOM     28  C   LIG    1       -7.541   0.417  -0.683  0.00  0.00    +0.105 C 
ENDBRANCH  25  27
ENDBRANCH  21  25
ENDBRANCH   1  22
TORSDOF 5