REMARK  Name = BDB058095
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.474   0.837   0.160  0.00  0.00    +0.132 C 
ATOM      2  C   LIG    1       -2.013   1.050   0.325  0.00  0.00    +0.060 C 
ATOM      3  C   LIG    1       -2.926  -0.001  -0.356  0.00  0.00    +0.032 C 
ATOM      4  C   LIG    1       -4.378   0.518  -0.286  0.00  0.00    +0.019 C 
ATOM      5  C   LIG    1       -2.891  -1.397   0.274  0.00  0.00    +0.019 C 
ATOM      6  C   LIG    1       -2.523  -0.155  -1.824  0.00  0.00    +0.179 C 
ATOM      7  O   LIG    1       -3.338  -0.468  -2.691  0.00  0.00    -0.291 OA
ATOM      8  C   LIG    1       -1.091   0.024  -2.188  0.00  0.00    +0.094 C 
ATOM      9  C   LIG    1       -0.199   0.455  -1.279  0.00  0.00    +0.036 C 
ENDROOT
BRANCH   1  10
ATOM     10  C   LIG    1        0.095  -0.186   1.187  0.00  0.00    +0.085 A 
ATOM     11  C   LIG    1        1.423  -0.675   1.176  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1        1.822  -1.582   2.174  0.00  0.00    +0.050 A 
ATOM     13  C   LIG    1        0.929  -1.960   3.158  0.00  0.00    +0.142 A 
ATOM     14  F   LIG    1        1.298  -2.817   4.117  0.00  0.00    -0.204 F 
ATOM     15  C   LIG    1       -0.339  -1.429   3.135  0.00  0.00    +0.149 A 
ATOM     16  N   LIG    1       -0.765  -0.562   2.186  0.00  0.00    -0.253 NA
BRANCH  11  17
ATOM     17  C   LIG    1        2.436  -0.280   0.223  0.00  0.00    +0.021 A 
ATOM     18  C   LIG    1        2.983  -1.121  -0.725  0.00  0.00    +0.116 A 
ATOM     19  N   LIG    1        3.897  -0.372  -1.408  0.00  0.00    -0.274 N 
ATOM     20  C   LIG    1        4.718  -0.798  -2.516  0.00  0.00    +0.172 C 
ATOM     21  N   LIG    1        3.994   0.893  -0.960  0.00  0.00    -0.179 NA
ATOM     22  C   LIG    1        3.122   0.941   0.050  0.00  0.00    +0.143 A 
ENDBRANCH  11  17
ENDBRANCH   1  10
BRANCH   1  24
ATOM     23  C   LIG    1       -0.122   3.252  -0.183  0.00  0.00    +0.195 C 
ATOM     24  O   LIG    1        0.249   2.049   0.470  0.00  0.00    -0.366 OA
ENDBRANCH   1  24
BRANCH   8  25
ATOM     25  C   LIG    1       -0.679  -0.265  -3.520  0.00  0.00    +0.102 C 
ATOM     26  N   LIG    1       -0.272  -0.492  -4.583  0.00  0.00    -0.191 NA
ENDBRANCH   8  25
TORSDOF 4