REMARK  Name = BDB042476
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.457  -1.421  -0.344  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.817  -2.086  -0.606  0.00  0.00    +0.054 C 
BRANCH   2  10
ATOM      3  C   LIG    1       -6.280  -0.479   1.822  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1       -6.126   0.257   0.518  0.00  0.00    -0.042 A 
ATOM      5  C   LIG    1       -5.032   0.036  -0.350  0.00  0.00    -0.005 A 
ATOM      6  C   LIG    1       -4.950   0.763  -1.557  0.00  0.00    +0.082 A 
ATOM      7  C   LIG    1       -3.801   0.529  -2.465  0.00  0.00    +0.259 A 
ATOM      8  N   LIG    1       -2.873  -0.401  -2.050  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1       -2.105  -0.545  -2.695  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1       -2.935  -1.109  -0.876  0.00  0.00    +0.020 A 
ATOM     11  O   LIG    1       -3.655   1.113  -3.532  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -5.938   1.688  -1.889  0.00  0.00    +0.136 A 
ATOM     13  F   LIG    1       -5.889   2.394  -3.027  0.00  0.00    -0.205 F 
ATOM     14  C   LIG    1       -7.014   1.906  -1.037  0.00  0.00    +0.039 A 
ATOM     15  C   LIG    1       -3.966  -0.930  -0.037  0.00  0.00    +0.030 A 
ATOM     16  C   LIG    1       -7.109   1.196   0.159  0.00  0.00    +0.007 A 
ENDBRANCH   2  10
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1       -0.452  -0.574   0.939  0.00  0.00    +0.085 C 
BRANCH  17  18
ATOM     18  N   LIG    1        0.816   0.072   1.285  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1        1.307   1.035   0.283  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        2.584   0.613  -0.483  0.00  0.00    +0.120 C 
ATOM     21  N   LIG    1        3.675   0.261   0.444  0.00  0.00    -0.325 N 
ATOM     22  C   LIG    1        3.274  -0.226   1.774  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        1.863  -0.860   1.730  0.00  0.00    +0.103 C 
BRANCH  21  24
ATOM     24  C   LIG    1        5.004   0.307   0.046  0.00  0.00    +0.066 A 
ATOM     25  C   LIG    1        5.411   0.308  -1.305  0.00  0.00    +0.146 A 
ATOM     26  F   LIG    1        4.503   0.226  -2.293  0.00  0.00    -0.204 F 
ATOM     27  C   LIG    1        6.752   0.361  -1.692  0.00  0.00    +0.059 A 
ATOM     28  C   LIG    1        7.750   0.417  -0.724  0.00  0.00    +0.055 A 
ATOM     29  C   LIG    1        7.392   0.421   0.623  0.00  0.00    +0.021 A 
ATOM     30  C   LIG    1        6.040   0.366   0.996  0.00  0.00    +0.027 A 
BRANCH  28  31
ATOM     31  C   LIG    1        9.129   0.471  -1.108  0.00  0.00    +0.099 C 
ATOM     32  N   LIG    1       10.247   0.513  -1.416  0.00  0.00    -0.191 NA
ENDBRANCH  28  31
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 6