REMARK  Name = BDB000106
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.965   0.649  -0.695  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -4.565   1.083  -1.041  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -3.542   0.362  -0.478  0.00  0.00    -0.291 N 
ATOM      4  C   LIG    1       -2.135   0.729  -0.770  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -1.414  -0.275   0.017  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -2.288  -1.127   0.689  0.00  0.00    +0.087 A 
ATOM      7  N   LIG    1       -1.685  -2.057   1.419  0.00  0.00    -0.175 NA
ATOM      8  N   LIG    1       -0.371  -1.779   1.196  0.00  0.00    -0.263 N 
ATOM      9  H   LIG    1        0.350  -2.348   1.633  0.00  0.00    +0.190 HD
ATOM     10  C   LIG    1       -0.160  -0.701   0.350  0.00  0.00    +0.126 A 
ATOM     11  C   LIG    1       -3.700  -0.803   0.438  0.00  0.00    +0.165 C 
ATOM     12  O   LIG    1       -4.359   2.037  -1.790  0.00  0.00    -0.276 OA
ENDROOT
BRANCH  10  13
ATOM     13  N   LIG    1        1.082  -0.229  -0.021  0.00  0.00    -0.266 N 
ATOM     14  H   LIG    1        1.117   0.544  -0.673  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1        2.246  -0.840   0.417  0.00  0.00    +0.249 C 
ATOM     16  O   LIG    1        2.284  -1.844   1.124  0.00  0.00    -0.270 OA
BRANCH  15  17
ATOM     17  C   LIG    1        3.520  -0.224  -0.046  0.00  0.00    +0.040 A 
ATOM     18  C   LIG    1        3.635   1.148  -0.287  0.00  0.00    +0.051 A 
ATOM     19  C   LIG    1        4.856   1.662  -0.714  0.00  0.00    +0.124 A 
ATOM     20  F   LIG    1        4.965   2.977  -0.947  0.00  0.00    -0.205 F 
ATOM     21  C   LIG    1        5.964   0.842  -0.897  0.00  0.00    +0.038 A 
ATOM     22  C   LIG    1        5.857  -0.524  -0.641  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        4.639  -1.056  -0.211  0.00  0.00    +0.013 A 
ENDBRANCH  15  17
ENDBRANCH  10  13
TORSDOF 2