REMARK  Name = BDB041975
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        4.616   0.041  -0.176  0.00  0.00    -0.268 OA
ATOM      2  C   LIG    1        3.398   0.023  -0.055  0.00  0.00    +0.254 A 
ATOM      3  N   LIG    1        2.699  -1.074   0.341  0.00  0.00    -0.275 N 
ATOM      4  H   LIG    1        3.229  -1.916   0.506  0.00  0.00    +0.173 HD
ATOM      5  C   LIG    1        1.331  -1.219   0.348  0.00  0.00    +0.334 A 
ATOM      6  O   LIG    1        0.879  -2.341   0.570  0.00  0.00    -0.246 OA
ATOM      7  N   LIG    1        0.585  -0.056   0.056  0.00  0.00    -0.268 N 
ATOM      8  C   LIG    1        1.259   1.119  -0.268  0.00  0.00    +0.101 A 
ATOM      9  C   LIG    1        2.589   1.210  -0.336  0.00  0.00    +0.088 A 
ENDROOT
BRANCH   7  10
ATOM     10  C   LIG    1       -0.864  -0.104   0.083  0.00  0.00    +0.069 A 
ATOM     11  C   LIG    1       -1.585  -1.034   0.839  0.00  0.00    +0.137 A 
ATOM     12  N   LIG    1       -2.942  -1.099   0.914  0.00  0.00    -0.261 NA
ATOM     13  C   LIG    1       -3.637  -0.203   0.191  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1       -3.039   0.760  -0.598  0.00  0.00    +0.022 A 
ATOM     15  C   LIG    1       -1.643   0.807  -0.648  0.00  0.00    +0.029 A 
ENDBRANCH   7  10
TORSDOF 1