REMARK  Name = BDB061432
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.938  -0.792  -2.073  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.646  -0.485  -1.603  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        0.527  -0.863  -2.286  0.00  0.00    +0.038 A 
ATOM      4  C   LIG    1        0.414  -1.566  -3.478  0.00  0.00    +0.061 A 
ATOM      5  C   LIG    1       -0.850  -1.868  -3.966  0.00  0.00    +0.127 A 
ATOM      6  F   LIG    1       -0.966  -2.545  -5.117  0.00  0.00    -0.205 F 
ATOM      7  C   LIG    1       -2.005  -1.489  -3.284  0.00  0.00    +0.061 A 
ENDROOT
BRANCH   1  10
ATOM      8  C   LIG    1       -4.512  -0.077   0.486  0.00  0.00    +0.094 C 
ATOM      9  C   LIG    1       -3.054   0.081  -0.002  0.00  0.00    +0.127 C 
ATOM     10  N   LIG    1       -3.069  -0.402  -1.391  0.00  0.00    -0.328 N 
ATOM     11  C   LIG    1       -4.427  -0.763  -1.796  0.00  0.00    +0.107 C 
ATOM     12  C   LIG    1       -5.312  -0.002  -0.814  0.00  0.00    +0.043 C 
BRANCH   8  15
ATOM     13  C   LIG    1       -4.734   1.526   3.949  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1       -4.359   0.596   2.824  0.00  0.00    +0.213 C 
ATOM     15  N   LIG    1       -4.888   0.855   1.562  0.00  0.00    -0.300 N 
ATOM     16  C   LIG    1       -5.553   2.104   1.210  0.00  0.00    +0.132 C 
ATOM     17  O   LIG    1       -3.605  -0.356   3.035  0.00  0.00    -0.276 OA
ENDBRANCH   8  15
ENDBRANCH   1  10
BRANCH   3  18
ATOM     18  N   LIG    1        1.759  -0.514  -1.689  0.00  0.00    -0.280 N 
ATOM     19  H   LIG    1        1.694  -0.005  -0.820  0.00  0.00    +0.155 HD
ATOM     20  C   LIG    1        3.026  -0.654  -2.230  0.00  0.00    +0.265 C 
ATOM     21  O   LIG    1        3.267  -1.001  -3.379  0.00  0.00    -0.268 OA
BRANCH  20  22
ATOM     22  C   LIG    1        4.087  -0.302  -1.303  0.00  0.00    +0.103 A 
ATOM     23  N   LIG    1        4.047  -0.452   0.067  0.00  0.00    -0.350 N 
ATOM     24  H   LIG    1        3.278  -0.865   0.576  0.00  0.00    +0.166 HD
ATOM     25  C   LIG    1        5.218  -0.025   0.654  0.00  0.00    +0.053 A 
ATOM     26  C   LIG    1        6.059   0.377  -0.386  0.00  0.00    +0.036 A 
ATOM     27  C   LIG    1        7.342   0.853  -0.069  0.00  0.00    +0.133 A 
ATOM     28  C   LIG    1        7.756   0.916   1.259  0.00  0.00    +0.039 A 
ATOM     29  C   LIG    1        6.899   0.506   2.278  0.00  0.00    +0.008 A 
ATOM     30  F   LIG    1        8.181   1.249  -1.036  0.00  0.00    -0.205 F 
ATOM     31  C   LIG    1        5.601   0.022   2.009  0.00  0.00    -0.026 A 
ATOM     32  C   LIG    1        4.732  -0.414   3.153  0.00  0.00    +0.046 C 
ATOM     33  C   LIG    1        5.349   0.180  -1.601  0.00  0.00    +0.043 A 
ENDBRANCH  20  22
ENDBRANCH   3  18
TORSDOF 4