REMARK  Name = BDB063161
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.182   2.160  -0.847  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1       -1.489   1.038  -0.119  0.00  0.00    -0.042 A 
ATOM      3  C   LIG    1       -2.205  -0.071   0.381  0.00  0.00    -0.015 A 
ATOM      4  C   LIG    1       -1.498  -1.089   1.044  0.00  0.00    +0.009 A 
ATOM      5  C   LIG    1       -0.113  -1.020   1.211  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1        0.602   0.077   0.721  0.00  0.00    -0.030 A 
ATOM      7  C   LIG    1       -0.095   1.094   0.051  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1       -3.660  -0.198   0.231  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1       -4.524   0.212   1.256  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1       -5.910   0.089   1.116  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1       -6.462  -0.458  -0.051  0.00  0.00    +0.055 A 
ATOM     12  C   LIG    1       -5.600  -0.864  -1.080  0.00  0.00    +0.013 A 
ATOM     13  C   LIG    1       -4.215  -0.739  -0.938  0.00  0.00    +0.009 A 
BRANCH  11  14
ATOM     14  C   LIG    1       -7.958  -0.570  -0.213  0.00  0.00    +0.417 C 
ATOM     15  F   LIG    1       -8.503   0.543  -0.776  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1       -8.612  -0.751   0.969  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1       -8.333  -1.613  -1.006  0.00  0.00    -0.166 F 
ENDBRANCH  11  14
ENDBRANCH   3   8
BRANCH   6  18
ATOM     18  C   LIG    1        2.102   0.158   0.879  0.00  0.00    +0.137 C 
BRANCH  18  19
ATOM     19  N   LIG    1        2.732  -0.108  -0.408  0.00  0.00    -0.340 N 
ATOM     20  H   LIG    1        2.225  -0.799  -0.957  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1        4.117  -0.217  -0.517  0.00  0.00    +0.031 A 
ATOM     22  C   LIG    1        5.012   0.286   0.435  0.00  0.00    +0.038 A 
ATOM     23  C   LIG    1        6.400   0.208   0.238  0.00  0.00    +0.063 A 
ATOM     24  C   LIG    1        6.918  -0.321  -0.943  0.00  0.00    +0.053 A 
ATOM     25  C   LIG    1        6.032  -0.784  -1.904  0.00  0.00    +0.126 A 
ATOM     26  F   LIG    1        6.513  -1.283  -3.050  0.00  0.00    -0.205 F 
ATOM     27  C   LIG    1        4.655  -0.731  -1.705  0.00  0.00    +0.061 A 
BRANCH  23  28
ATOM     28  C   LIG    1        7.287   0.743   1.295  0.00  0.00    +0.337 C 
ATOM     29  O   LIG    1        7.020   1.739   1.943  0.00  0.00    -0.245 OA
BRANCH  28  30
ATOM     30  O   LIG    1        8.390  -0.007   1.498  0.00  0.00    -0.477 OA
ATOM     31  H   LIG    1        8.401  -0.866   1.036  0.00  0.00    +0.295 HD
ENDBRANCH  28  30
ENDBRANCH  23  28
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 7