REMARK  Name = BDB052543
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.189   0.267  -0.117  0.00  0.00    +0.038 A 
ATOM      2  C   LIG    1        0.455  -0.515   0.853  0.00  0.00    +0.016 A 
ATOM      3  C   LIG    1        1.846  -0.656   0.830  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1        2.585  -0.011  -0.158  0.00  0.00    +0.117 A 
ATOM      5  C   LIG    1        1.960   0.778  -1.116  0.00  0.00    +0.046 A 
ATOM      6  C   LIG    1        0.572   0.923  -1.094  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   1   9
ATOM      7  N   LIG    1       -2.423  -0.584   0.409  0.00  0.00    -0.250 N 
ATOM      8  H   LIG    1       -2.001  -1.490   0.595  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1       -1.666   0.450  -0.133  0.00  0.00    +0.257 C 
ATOM     10  O   LIG    1       -2.168   1.454  -0.631  0.00  0.00    -0.269 OA
BRANCH   7  11
ATOM     11  N   LIG    1       -3.832  -0.514   0.324  0.00  0.00    -0.254 NA
ATOM     12  H   LIG    1       -4.140   0.176   1.018  0.00  0.00    +0.140 HD
ATOM     13  H   LIG    1       -4.051  -0.048  -0.567  0.00  0.00    +0.140 HD
ENDBRANCH   7  11
ENDBRANCH   1   9
BRANCH   4  14
ATOM     14  O   LIG    1        3.942  -0.122  -0.216  0.00  0.00    -0.507 OA
ATOM     15  H   LIG    1        4.246  -0.682   0.517  0.00  0.00    +0.292 HD
ENDBRANCH   4  14
TORSDOF 3