REMARK  Name = BDB025474
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        3.221  -0.249  -0.648  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1        1.977   0.537  -0.861  0.00  0.00    +0.140 C 
ATOM      3  C   LIG    1        0.969   0.174   0.171  0.00  0.00    +0.067 A 
ATOM      4  C   LIG    1        1.220  -0.513   1.337  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1       -0.021  -0.605   1.970  0.00  0.00    +0.142 A 
ATOM      6  N   LIG    1       -0.982  -0.005   1.278  0.00  0.00    -0.149 NA
ATOM      7  C   LIG    1        2.583  -0.991   1.671  0.00  0.00    +0.056 C 
ATOM      8  N   LIG    1       -0.374   0.490   0.167  0.00  0.00    -0.201 N 
ATOM      9  C   LIG    1       -1.085   1.243  -0.786  0.00  0.00    +0.255 C 
ATOM     10  O   LIG    1       -0.468   1.753  -1.721  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1        3.628  -0.272   0.776  0.00  0.00    +0.090 C 
ENDROOT
BRANCH   9  12
ATOM     12  C   LIG    1       -2.585   1.401  -0.601  0.00  0.00    +0.113 C 
ATOM     13  C   LIG    1       -3.394   0.119  -0.650  0.00  0.00    -0.012 A 
ATOM     14  C   LIG    1       -4.437  -0.094   0.271  0.00  0.00    +0.031 A 
ATOM     15  C   LIG    1       -5.254  -1.226   0.131  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1       -5.001  -2.173  -0.862  0.00  0.00    +0.040 A 
ATOM     17  C   LIG    1       -3.953  -1.969  -1.744  0.00  0.00    +0.124 A 
ATOM     18  F   LIG    1       -3.716  -2.867  -2.710  0.00  0.00    -0.205 F 
ATOM     19  N   LIG    1       -4.776   0.877   1.230  0.00  0.00    -0.344 N 
ATOM     20  H   LIG    1       -5.298   0.466   2.000  0.00  0.00    +0.146 HD
ATOM     21  C   LIG    1       -3.648   1.671   1.702  0.00  0.00    +0.102 C 
ATOM     22  C   LIG    1       -3.158  -0.832  -1.659  0.00  0.00    +0.044 A 
ATOM     23  C   LIG    1       -2.950   2.360   0.542  0.00  0.00    +0.036 C 
ENDBRANCH   9  12
BRANCH   1  25
ATOM     24  C   LIG    1        5.024   1.444  -1.232  0.00  0.00    +0.024 C 
ATOM     25  C   LIG    1        4.280   0.153  -1.593  0.00  0.00    +0.051 C 
ATOM     26  C   LIG    1        5.280  -0.995  -1.783  0.00  0.00    +0.024 C 
ENDBRANCH   1  25
BRANCH   5  27
ATOM     27  N   LIG    1       -0.235  -1.226   3.136  0.00  0.00    -0.341 N 
ATOM     28  H   LIG    1        0.393  -1.969   3.419  0.00  0.00    +0.144 HD
ATOM     29  H   LIG    1       -1.206  -1.444   3.338  0.00  0.00    +0.144 HD
ENDBRANCH   5  27
TORSDOF 3