REMARK  Name = BDB034441
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.872  -0.536   1.503  0.00  0.00    +0.057 A 
ATOM      2  C   LIG    1        5.866   0.245   0.338  0.00  0.00    +0.040 A 
ATOM      3  C   LIG    1        4.695   0.737  -0.223  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1        3.452   0.441   0.386  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        2.267   0.942  -0.234  0.00  0.00    +0.038 A 
ATOM      6  C   LIG    1        2.420   1.773  -1.345  0.00  0.00    +0.043 A 
ATOM      7  C   LIG    1        3.685   2.001  -1.852  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1        3.465  -0.326   1.578  0.00  0.00    +0.012 A 
ATOM      9  N   LIG    1        4.810   1.487  -1.325  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1        4.655  -0.806   2.128  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1  12
ATOM     11  F   LIG    1        7.763  -0.093   2.886  0.00  0.00    -0.166 F 
ATOM     12  C   LIG    1        7.173  -1.023   2.086  0.00  0.00    +0.417 C 
ATOM     13  F   LIG    1        8.096  -1.344   1.138  0.00  0.00    -0.166 F 
ATOM     14  F   LIG    1        7.029  -2.139   2.854  0.00  0.00    -0.166 F 
ENDBRANCH   1  12
BRANCH   5  15
ATOM     15  N   LIG    1        1.010   0.695   0.343  0.00  0.00    -0.343 N 
ATOM     16  H   LIG    1        0.973  -0.209   0.804  0.00  0.00    +0.146 HD
BRANCH  15  17
ATOM     17  C   LIG    1       -0.249   1.018  -0.327  0.00  0.00    +0.103 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.574  -0.002  -1.419  0.00  0.00    +0.034 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.848   0.339  -2.200  0.00  0.00    +0.083 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -3.086   0.388  -1.430  0.00  0.00    -0.312 NA
ATOM     21  H   LIG    1       -3.021   1.030  -0.642  0.00  0.00    +0.122 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -3.532  -0.920  -0.959  0.00  0.00    +0.116 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -4.824  -0.795  -0.186  0.00  0.00    -0.034 A 
ATOM     24  C   LIG    1       -6.021  -0.495  -0.853  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1       -7.217  -0.370  -0.144  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -7.228  -0.541   1.239  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -6.044  -0.832   1.914  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -4.847  -0.957   1.206  0.00  0.00    +0.005 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  15  17
ENDBRANCH   5  15
TORSDOF 8