REMARK  Name = BDB056191
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.465   0.048  -0.252  0.00  0.00    +0.019 A 
ATOM      2  N   LIG    1        1.308  -1.295  -0.497  0.00  0.00    -0.326 N 
ATOM      3  H   LIG    1        2.118  -1.879  -0.670  0.00  0.00    +0.169 HD
ATOM      4  C   LIG    1        0.101  -1.952  -0.541  0.00  0.00    +0.257 A 
ATOM      5  O   LIG    1        0.033  -3.154  -0.773  0.00  0.00    -0.267 OA
ATOM      6  C   LIG    1       -1.110  -1.127  -0.298  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1       -0.967   0.249  -0.030  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1       -2.124   1.012   0.225  0.00  0.00    +0.033 A 
ATOM      9  C   LIG    1       -3.384   0.402   0.111  0.00  0.00    +0.023 A 
ATOM     10  C   LIG    1       -3.510  -0.961  -0.159  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1       -2.370  -1.732  -0.355  0.00  0.00    +0.014 A 
ATOM     12  C   LIG    1        0.391   0.823  -0.033  0.00  0.00    +0.031 A 
ENDROOT
BRANCH   8  13
ATOM     13  N   LIG    1       -2.110   2.413   0.391  0.00  0.00    -0.357 N 
ATOM     14  H   LIG    1       -2.302   2.881  -0.493  0.00  0.00    +0.142 HD
ATOM     15  H   LIG    1       -1.246   2.764   0.789  0.00  0.00    +0.142 HD
ENDBRANCH   8  13
BRANCH   1  17
ATOM     16  C   LIG    1        3.672   0.159   0.951  0.00  0.00    +0.010 C 
ATOM     17  C   LIG    1        2.873   0.587  -0.272  0.00  0.00    +0.050 C 
ENDBRANCH   1  17
TORSDOF 2