REMARK  Name = BDB025343
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.146   0.350   0.987  0.00  0.00    +0.105 C 
ATOM      2  N   LIG    1        4.923  -0.142  -0.371  0.00  0.00    -0.301 NA
ATOM      3  C   LIG    1        4.024  -1.320  -0.392  0.00  0.00    +0.124 C 
ATOM      4  C   LIG    1        2.594  -0.916  -0.301  0.00  0.00    +0.029 A 
ATOM      5  C   LIG    1        2.132   0.379  -0.604  0.00  0.00    +0.071 A 
ATOM      6  N   LIG    1        0.812   0.512  -0.481  0.00  0.00    -0.167 NA
ATOM      7  N   LIG    1        0.385  -0.731  -0.091  0.00  0.00    -0.185 N 
ATOM      8  C   LIG    1       -0.978  -0.983   0.173  0.00  0.00    +0.256 C 
ATOM      9  O   LIG    1       -1.313  -2.086   0.605  0.00  0.00    -0.270 OA
ATOM     10  C   LIG    1        3.044   1.490  -0.979  0.00  0.00    +0.073 C 
ATOM     11  C   LIG    1        1.460  -1.626   0.018  0.00  0.00    +0.127 A 
ATOM     12  C   LIG    1        4.451   0.927  -1.284  0.00  0.00    +0.090 C 
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1       -1.903   0.200  -0.074  0.00  0.00    +0.111 C 
ATOM     14  C   LIG    1       -3.299  -0.244  -0.446  0.00  0.00    -0.013 A 
ATOM     15  C   LIG    1       -4.436   0.343   0.087  0.00  0.00    +0.021 A 
ATOM     16  N   LIG    1       -5.536  -0.259  -0.464  0.00  0.00    -0.349 N 
ATOM     17  H   LIG    1       -6.504  -0.050  -0.261  0.00  0.00    +0.166 HD
ATOM     18  C   LIG    1       -5.106  -1.197  -1.351  0.00  0.00    +0.107 A 
ATOM     19 CL   LIG    1       -6.274  -2.092  -2.196  0.00  0.00    -0.064 Cl
ATOM     20  C   LIG    1       -4.476   1.426   1.104  0.00  0.00    +0.053 C 
ATOM     21  C   LIG    1       -3.099   2.107   1.178  0.00  0.00    +0.007 C 
ATOM     22  C   LIG    1       -3.736  -1.223  -1.380  0.00  0.00    +0.044 A 
ATOM     23  C   LIG    1       -1.945   1.087   1.200  0.00  0.00    +0.018 C 
ENDBRANCH   8  13
BRANCH  11  24
ATOM     24  N   LIG    1        1.312  -2.926   0.363  0.00  0.00    -0.343 N 
ATOM     25  H   LIG    1        0.402  -3.258   0.704  0.00  0.00    +0.144 HD
ATOM     26  H   LIG    1        2.094  -3.499   0.664  0.00  0.00    +0.144 HD
ENDBRANCH  11  24
TORSDOF 2