REMARK  Name = BDB013207
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.629  -0.246   0.194  0.00  0.00    +0.203 A 
ATOM      2  N   LIG    1        1.166   0.697  -0.685  0.00  0.00    -0.253 N 
ATOM      3  C   LIG    1        2.515   0.850  -0.892  0.00  0.00    +0.173 A 
ATOM      4  N   LIG    1        2.711   1.803  -1.779  0.00  0.00    -0.129 NA
ATOM      5  N   LIG    1        1.480   2.311  -2.134  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        3.390   0.009  -0.148  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1        2.792  -0.843   0.715  0.00  0.00    +0.126 A 
ATOM      8  C   LIG    1        0.569   1.651  -1.455  0.00  0.00    +0.232 A 
ATOM      9  N   LIG    1        1.431  -0.995   0.901  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1        4.864   0.056  -0.234  0.00  0.00    +0.023 A 
ATOM     11  C   LIG    1        5.564   1.244  -0.362  0.00  0.00    +0.122 A 
ATOM     12  N   LIG    1        6.911   1.332  -0.441  0.00  0.00    -0.243 NA
ATOM     13  C   LIG    1        7.574   0.168  -0.409  0.00  0.00    +0.221 A 
ATOM     14  N   LIG    1        7.020  -1.048  -0.306  0.00  0.00    -0.243 NA
ATOM     15  C   LIG    1        5.671  -1.070  -0.229  0.00  0.00    +0.122 A 
ENDBRANCH   6  10
BRANCH   1  16
ATOM     16  N   LIG    1       -0.733  -0.380   0.350  0.00  0.00    -0.310 N 
ATOM     17  H   LIG    1       -0.883  -0.966   1.174  0.00  0.00    +0.149 HD
BRANCH  16  18
ATOM     18  C   LIG    1       -1.526  -0.949  -0.739  0.00  0.00    +0.143 C 
BRANCH  18  21
ATOM     19  F   LIG    1       -2.823  -3.430  -0.337  0.00  0.00    -0.205 F 
ATOM     20  C   LIG    1       -3.553  -2.322  -0.142  0.00  0.00    +0.129 A 
ATOM     21  C   LIG    1       -2.961  -1.064  -0.317  0.00  0.00    +0.012 A 
ATOM     22  C   LIG    1       -3.771   0.046  -0.091  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1       -3.482   1.493  -0.244  0.00  0.00    +0.080 C 
ATOM     24  C   LIG    1       -4.715   2.070   0.453  0.00  0.00    +0.234 C 
ATOM     25  O   LIG    1       -5.771   1.083   0.434  0.00  0.00    -0.491 OA
ATOM     26  C   LIG    1       -5.104  -0.103   0.273  0.00  0.00    +0.124 A 
ATOM     27  C   LIG    1       -5.692  -1.341   0.432  0.00  0.00    +0.049 A 
ATOM     28  C   LIG    1       -4.898  -2.468   0.226  0.00  0.00    +0.042 A 
ENDBRANCH  18  21
ENDBRANCH  16  18
ENDBRANCH   1  16
TORSDOF 4