REMARK  Name = BDB050437
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.348  -0.261  -0.708  0.00  0.00    +0.011 A 
ATOM      2  C   LIG    1        1.407   0.088   0.157  0.00  0.00    +0.058 A 
ATOM      3  C   LIG    1        2.722  -0.349  -0.034  0.00  0.00    +0.041 A 
ATOM      4  C   LIG    1        3.516   0.194   1.026  0.00  0.00    -0.023 A 
ATOM      5  C   LIG    1        2.669   0.938   1.822  0.00  0.00    +0.087 A 
ATOM      6  C   LIG    1        4.975  -0.009   1.226  0.00  0.00    +0.046 C 
ATOM      7  C   LIG    1        2.996  -1.172  -1.143  0.00  0.00    +0.168 A 
ATOM      8  F   LIG    1        4.242  -1.616  -1.369  0.00  0.00    -0.202 F 
ATOM      9  C   LIG    1        1.966  -1.527  -2.010  0.00  0.00    +0.160 A 
ATOM     10  F   LIG    1        2.224  -2.310  -3.067  0.00  0.00    -0.202 F 
ATOM     11  N   LIG    1        1.409   0.869   1.294  0.00  0.00    -0.360 N 
ATOM     12  H   LIG    1        0.589   1.323   1.676  0.00  0.00    +0.165 HD
ATOM     13  C   LIG    1        0.665  -1.083  -1.803  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  15
ATOM     14  C   LIG    1       -1.920  -0.487   0.349  0.00  0.00    +0.051 A 
ATOM     15  C   LIG    1       -1.015   0.225  -0.466  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1       -1.466   1.434  -1.036  0.00  0.00    -0.038 A 
ATOM     17  C   LIG    1       -0.591   2.268  -1.934  0.00  0.00    +0.044 C 
ATOM     18  C   LIG    1       -2.771   1.864  -0.769  0.00  0.00    +0.047 A 
ATOM     19  C   LIG    1       -3.582   1.106   0.054  0.00  0.00    +0.117 A 
ATOM     20  N   LIG    1       -3.180  -0.045   0.608  0.00  0.00    -0.237 NA
BRANCH  19  21
ATOM     21  N   LIG    1       -4.890   1.498   0.321  0.00  0.00    -0.343 N 
ATOM     22  H   LIG    1       -4.932   2.439   0.693  0.00  0.00    +0.144 HD
ATOM     23  H   LIG    1       -5.275   0.816   0.971  0.00  0.00    +0.144 HD
ENDBRANCH  19  21
BRANCH  14  25
ATOM     24  C   LIG    1       -2.612  -2.481   1.806  0.00  0.00    +0.010 C 
ATOM     25  C   LIG    1       -1.517  -1.801   0.991  0.00  0.00    +0.053 C 
ENDBRANCH  14  25
ENDBRANCH   1  15
TORSDOF 3