REMARK  Name = BDB014140
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.668  -0.265  -0.764  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1       -2.143   0.603  -1.695  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1       -3.480   0.770  -1.757  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1       -4.379   0.121  -0.928  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1       -3.879  -0.757   0.033  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.499  -0.961   0.106  0.00  0.00    +0.040 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1       -4.750  -1.478   0.937  0.00  0.00    +0.124 A 
ATOM      8  C   LIG    1       -5.849  -1.002   1.615  0.00  0.00    +0.166 A 
ATOM      9  N   LIG    1       -6.277  -2.077   2.338  0.00  0.00    -0.253 N 
ATOM     10  H   LIG    1       -7.056  -2.154   2.984  0.00  0.00    +0.191 HD
ATOM     11  N   LIG    1       -5.501  -3.148   2.133  0.00  0.00    -0.067 NA
ATOM     12  N   LIG    1       -4.549  -2.790   1.282  0.00  0.00    -0.129 NA
BRANCH   8  13
ATOM     13  C   LIG    1       -6.525   0.284   1.707  0.00  0.00    +0.436 C 
ATOM     14  F   LIG    1       -7.418   0.300   2.731  0.00  0.00    -0.164 F 
ATOM     15  F   LIG    1       -5.669   1.310   1.916  0.00  0.00    -0.164 F 
ATOM     16  F   LIG    1       -7.224   0.567   0.581  0.00  0.00    -0.164 F 
ENDBRANCH   8  13
ENDBRANCH   5   7
BRANCH   1  19
ATOM     17  N   LIG    1        1.916  -0.287  -1.106  0.00  0.00    -0.332 N 
ATOM     18  C   LIG    1        0.698   0.166  -1.529  0.00  0.00    +0.117 A 
ATOM     19  C   LIG    1       -0.224  -0.444  -0.702  0.00  0.00    +0.107 A 
ATOM     20  N   LIG    1        0.420  -1.263   0.205  0.00  0.00    -0.234 NA
ATOM     21  C   LIG    1        1.702  -1.144  -0.064  0.00  0.00    +0.200 A 
BRANCH  17  22
ATOM     22  C   LIG    1        3.204   0.034  -1.701  0.00  0.00    +0.158 C 
BRANCH  22  25
ATOM     23  C   LIG    1        5.763  -1.078  -0.518  0.00  0.00    +0.044 C 
ATOM     24  C   LIG    1        5.272   0.310  -0.207  0.00  0.00    -0.046 A 
ATOM     25  C   LIG    1        4.081   0.830  -0.759  0.00  0.00    -0.025 A 
ATOM     26  C   LIG    1        3.693   2.143  -0.428  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1        4.461   2.925   0.432  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        5.633   2.411   0.974  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.036   1.115   0.656  0.00  0.00    +0.004 A 
ENDBRANCH  22  25
ENDBRANCH  17  22
ENDBRANCH   1  19
TORSDOF 5