REMARK  Name = BDB054144
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.533   0.225   0.083  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1       -0.146   0.478   0.087  0.00  0.00    +0.098 A 
ATOM      3  C   LIG    1        0.733  -0.594  -0.104  0.00  0.00    +0.066 A 
ATOM      4  C   LIG    1        2.176  -0.297  -0.112  0.00  0.00    +0.259 A 
ATOM      5  N   LIG    1        2.511   1.019   0.078  0.00  0.00    -0.313 N 
ATOM      6  H   LIG    1        3.498   1.232   0.077  0.00  0.00    +0.170 HD
ATOM      7  C   LIG    1        1.583   2.003   0.248  0.00  0.00    +0.199 A 
ATOM      8  O   LIG    1        3.023  -1.166  -0.279  0.00  0.00    -0.267 OA
ATOM      9  C   LIG    1        0.267  -1.901  -0.275  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -1.103  -2.147  -0.239  0.00  0.00    +0.003 A 
ATOM     11  N   LIG    1        0.310   1.808   0.255  0.00  0.00    -0.235 NA
ATOM     12  C   LIG    1       -1.997  -1.090  -0.045  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  13
ATOM     13  N   LIG    1       -2.440   1.258   0.400  0.00  0.00    -0.356 N 
ATOM     14  H   LIG    1       -1.990   2.165   0.266  0.00  0.00    +0.142 HD
ATOM     15  H   LIG    1       -3.335   1.179  -0.069  0.00  0.00    +0.142 HD
ENDBRANCH   1  13
TORSDOF 1