REMARK  Name = BDB057403
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.734  -0.267   0.164  0.00  0.00    +0.141 A 
ATOM      2  N   LIG    1        2.243  -1.193   1.048  0.00  0.00    -0.306 N 
ATOM      3  H   LIG    1        1.638  -1.761   1.622  0.00  0.00    +0.170 HD
ATOM      4  C   LIG    1        3.577  -1.495   1.146  0.00  0.00    +0.259 A 
ATOM      5  O   LIG    1        3.994  -2.352   1.916  0.00  0.00    -0.267 OA
ATOM      6  C   LIG    1        4.469  -0.729   0.262  0.00  0.00    +0.065 A 
ATOM      7  C   LIG    1        3.876   0.194  -0.602  0.00  0.00    +0.078 A 
ATOM      8  C   LIG    1        4.700   0.931  -1.455  0.00  0.00    +0.028 A 
ATOM      9  C   LIG    1        6.086   0.748  -1.441  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        6.663  -0.180  -0.572  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        5.854  -0.924   0.285  0.00  0.00    +0.015 A 
ATOM     12  N   LIG    1        2.488   0.407  -0.647  0.00  0.00    -0.229 NA
ENDROOT
BRANCH   1  16
ATOM     13  C   LIG    1       -2.555   0.297   0.072  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1       -1.755   0.505  -1.064  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1       -0.367   0.323  -1.020  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1        0.259  -0.081   0.162  0.00  0.00    +0.017 A 
ATOM     17  C   LIG    1       -0.514  -0.278   1.308  0.00  0.00    +0.012 A 
ATOM     18  C   LIG    1       -1.901  -0.093   1.258  0.00  0.00    +0.005 A 
BRANCH  13  20
ATOM     19  C   LIG    1       -4.776  -0.831   0.459  0.00  0.00    +0.015 C 
ATOM     20  C   LIG    1       -4.082   0.490   0.059  0.00  0.00    -0.013 C 
ATOM     21  C   LIG    1       -4.648   0.904  -1.318  0.00  0.00    +0.015 C 
ATOM     22  C   LIG    1       -4.473   1.594   1.065  0.00  0.00    +0.015 C 
ENDBRANCH  13  20
ENDBRANCH   1  16
TORSDOF 2