REMARK  Name = BDB057465
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        5.351   0.065  -0.803  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1        4.168   0.046  -0.504  0.00  0.00    +0.222 C 
ATOM      3  N   LIG    1        3.658  -0.009   0.788  0.00  0.00    -0.285 N 
ATOM      4  H   LIG    1        4.246  -0.037   1.607  0.00  0.00    +0.155 HD
ATOM      5  C   LIG    1        2.273  -0.017   0.780  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1        1.810   0.030  -0.531  0.00  0.00    -0.017 A 
ATOM      7  C   LIG    1        0.453   0.032  -0.803  0.00  0.00    +0.014 A 
ATOM      8  C   LIG    1       -0.456  -0.014   0.272  0.00  0.00    -0.017 A 
ATOM      9  C   LIG    1        0.050  -0.061   1.597  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1        1.424  -0.064   1.862  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1        2.978   0.077  -1.470  0.00  0.00    +0.133 C 
ENDROOT
BRANCH   8  12
ATOM     12  C   LIG    1       -1.908  -0.013   0.027  0.00  0.00    -0.015 A 
ATOM     13  C   LIG    1       -2.742   0.942   0.620  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1       -4.102   0.903   0.358  0.00  0.00    +0.111 A 
ATOM     15  N   LIG    1       -4.687  -0.011  -0.444  0.00  0.00    -0.263 NA
ATOM     16  C   LIG    1       -3.873  -0.926  -1.008  0.00  0.00    +0.111 A 
ATOM     17  C   LIG    1       -2.501  -0.966  -0.809  0.00  0.00    +0.028 A 
ENDBRANCH   8  12
TORSDOF 1