REMARK  Name = BDB050436
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.007   0.444   0.291  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1       -1.022  -0.256  -0.433  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1       -1.345  -0.642  -1.751  0.00  0.00    -0.038 A 
ATOM      4  C   LIG    1       -0.377  -1.405  -2.617  0.00  0.00    +0.044 C 
ATOM      5  C   LIG    1       -2.607  -0.321  -2.265  0.00  0.00    +0.047 A 
ATOM      6  C   LIG    1       -3.505   0.378  -1.479  0.00  0.00    +0.117 A 
ATOM      7  N   LIG    1       -3.227   0.757  -0.226  0.00  0.00    -0.237 NA
ENDROOT
BRANCH   2   8
ATOM      8  C   LIG    1        0.291  -0.565   0.141  0.00  0.00    +0.011 A 
ATOM      9  C   LIG    1        1.359   0.351   0.046  0.00  0.00    +0.055 A 
ATOM     10  C   LIG    1        2.628   0.100   0.573  0.00  0.00    +0.006 A 
ATOM     11  C   LIG    1        3.446   1.242   0.294  0.00  0.00    -0.025 A 
ATOM     12  C   LIG    1        2.656   2.143  -0.390  0.00  0.00    +0.087 A 
ATOM     13  C   LIG    1        4.873   1.420   0.668  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1        2.857  -1.125   1.228  0.00  0.00    +0.048 A 
ATOM     15  C   LIG    1        1.812  -2.042   1.325  0.00  0.00    +0.125 A 
ATOM     16  F   LIG    1        2.027  -3.211   1.945  0.00  0.00    -0.205 F 
ATOM     17  N   LIG    1        1.409   1.601  -0.534  0.00  0.00    -0.360 N 
ATOM     18  H   LIG    1        0.627   2.045  -0.997  0.00  0.00    +0.165 HD
ATOM     19  C   LIG    1        0.556  -1.778   0.796  0.00  0.00    +0.049 A 
ENDBRANCH   2   8
BRANCH   6  20
ATOM     20  N   LIG    1       -4.773   0.693  -1.956  0.00  0.00    -0.343 N 
ATOM     21  H   LIG    1       -5.235   1.232  -1.228  0.00  0.00    +0.144 HD
ATOM     22  H   LIG    1       -4.729   1.199  -2.832  0.00  0.00    +0.144 HD
ENDBRANCH   6  20
BRANCH   1  24
ATOM     23  C   LIG    1       -2.332  -0.148   2.708  0.00  0.00    +0.010 C 
ATOM     24  C   LIG    1       -1.806   0.885   1.723  0.00  0.00    +0.053 C 
ENDBRANCH   1  24
TORSDOF 3