REMARK  Name = BDB050481
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.029  -0.772  -0.617  0.00  0.00    +0.015 C 
ATOM      2  C   LIG    1        0.746  -0.614  -1.700  0.00  0.00    +0.053 C 
ENDROOT
BRANCH   1   4
ATOM      3  C   LIG    1       -2.023   0.347   0.388  0.00  0.00    +0.127 A 
ATOM      4  C   LIG    1       -1.471  -0.481  -0.613  0.00  0.00    +0.017 A 
ATOM      5  C   LIG    1       -2.310  -1.058  -1.578  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1       -3.681  -0.804  -1.564  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -4.223   0.021  -0.584  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1       -3.400   0.595   0.389  0.00  0.00    +0.046 A 
BRANCH   3  10
ATOM      9  C   LIG    1       -1.677   1.638   2.366  0.00  0.00    +0.277 C 
ATOM     10  O   LIG    1       -1.135   0.873   1.296  0.00  0.00    -0.495 OA
ENDBRANCH   3  10
ENDBRANCH   1   4
BRANCH   2  11
ATOM     11  C   LIG    1        2.215  -0.862  -1.696  0.00  0.00    +0.202 C 
ATOM     12  O   LIG    1        2.695  -1.391  -2.698  0.00  0.00    -0.286 OA
BRANCH  11  13
ATOM     13  C   LIG    1        3.023  -0.454  -0.558  0.00  0.00    +0.087 A 
ATOM     14  N   LIG    1        2.653   0.435   0.432  0.00  0.00    -0.358 N 
ATOM     15  H   LIG    1        1.760   0.909   0.485  0.00  0.00    +0.165 HD
ATOM     16  C   LIG    1        3.673   0.590   1.335  0.00  0.00    +0.083 A 
ATOM     17  C   LIG    1        4.730  -0.183   0.918  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        4.328  -0.829  -0.274  0.00  0.00    +0.031 A 
ENDBRANCH  11  13
ENDBRANCH   2  11
TORSDOF 4