REMARK  Name = BDB057426
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.076  -1.106  -0.670  0.00  0.00    +0.279 C 
ATOM      2  N   LIG    1       -1.408  -0.795  -0.288  0.00  0.00    -0.199 N 
ATOM      3  C   LIG    1       -1.898   0.161   0.600  0.00  0.00    +0.064 A 
ATOM      4  C   LIG    1       -1.067   0.994   1.506  0.00  0.00    +0.067 C 
ATOM      5  C   LIG    1       -3.272   0.111   0.488  0.00  0.00    +0.085 A 
ATOM      6 CL   LIG    1       -4.421   1.068   1.291  0.00  0.00    -0.080 Cl
ATOM      7  C   LIG    1       -3.549  -0.936  -0.409  0.00  0.00    +0.079 A 
ATOM      8  C   LIG    1       -4.870  -1.438  -0.861  0.00  0.00    +0.069 C 
ATOM      9  N   LIG    1       -2.428  -1.511  -0.848  0.00  0.00    -0.167 NA
ATOM     10  O   LIG    1        0.150  -2.195  -1.200  0.00  0.00    -0.265 OA
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1        4.570  -0.363   1.007  0.00  0.00    +0.044 C 
ATOM     12  C   LIG    1        3.346   0.138   0.297  0.00  0.00    -0.050 A 
ATOM     13  C   LIG    1        2.230  -0.692   0.138  0.00  0.00    +0.016 A 
ATOM     14  C   LIG    1        1.079  -0.205  -0.492  0.00  0.00    +0.041 A 
ATOM     15  C   LIG    1        1.044   1.097  -1.001  0.00  0.00    +0.013 A 
ATOM     16  C   LIG    1        2.150   1.929  -0.830  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        3.289   1.456  -0.175  0.00  0.00    +0.003 A 
ENDBRANCH   1  14
TORSDOF 1