REMARK  Name = BDB037274
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.740   5.601   0.966  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        1.022   4.540   0.424  0.00  0.00    +0.244 C 
ATOM      3  C   LIG    1        0.020   3.459   0.354  0.00  0.00    +0.039 A 
ATOM      4  C   LIG    1        0.090   2.418   1.278  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1       -0.774   1.327   1.165  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1       -1.726   1.292   0.122  0.00  0.00    +0.009 A 
ATOM      7  C   LIG    1       -1.815   2.387  -0.740  0.00  0.00    +0.048 A 
ATOM      8  N   LIG    1       -2.829   2.114  -1.630  0.00  0.00    -0.360 N 
ATOM      9  H   LIG    1       -3.117   2.733  -2.375  0.00  0.00    +0.165 HD
ATOM     10  C   LIG    1       -3.317   0.847  -1.423  0.00  0.00    +0.093 A 
ATOM     11  C   LIG    1       -2.669   0.310  -0.329  0.00  0.00    +0.026 A 
ATOM     12  C   LIG    1       -2.798  -1.070   0.120  0.00  0.00    +0.090 A 
ATOM     13  N   LIG    1       -1.599  -1.681   0.234  0.00  0.00    -0.214 NA
ATOM     14  C   LIG    1       -1.547  -2.944   0.649  0.00  0.00    +0.216 A 
ATOM     15  N   LIG    1       -2.639  -3.652   0.934  0.00  0.00    -0.222 NA
ATOM     16  C   LIG    1       -3.827  -3.018   0.810  0.00  0.00    +0.129 A 
ATOM     17  N   LIG    1       -0.319  -3.563   0.844  0.00  0.00    -0.309 N 
ATOM     18  H   LIG    1       -0.522  -4.555   0.912  0.00  0.00    +0.149 HD
ATOM     19  C   LIG    1        0.731  -3.222  -0.122  0.00  0.00    +0.088 C 
ATOM     20  C   LIG    1        1.162  -1.744  -0.092  0.00  0.00    +0.106 C 
ATOM     21  N   LIG    1        2.628  -1.752  -0.243  0.00  0.00    -0.301 NA
ATOM     22  C   LIG    1        3.040  -2.892   0.579  0.00  0.00    +0.086 C 
ATOM     23  C   LIG    1        3.232  -0.489   0.208  0.00  0.00    +0.084 C 
ATOM     24  C   LIG    1        2.833   0.688  -0.696  0.00  0.00    +0.017 C 
ATOM     25  C   LIG    1        3.261   2.040  -0.117  0.00  0.00    +0.020 C 
ATOM     26  C   LIG    1        2.685   3.194  -0.944  0.00  0.00    +0.104 C 
ATOM     27  C   LIG    1        2.027  -3.973   0.213  0.00  0.00    +0.039 C 
ATOM     28  C   LIG    1       -3.977  -1.705   0.414  0.00  0.00    +0.099 A 
ATOM     29  C   LIG    1       -0.959   3.494  -0.649  0.00  0.00    +0.039 A 
ATOM     30  N   LIG    1        2.265   4.320  -0.124  0.00  0.00    -0.311 N 
ATOM     31  H   LIG    1        2.894   5.108  -0.028  0.00  0.00    +0.149 HD
ENDROOT
BRANCH  28  32
ATOM     32  C   LIG    1       -5.316  -1.076   0.331  0.00  0.00    +0.421 C 
ATOM     33  F   LIG    1       -6.284  -1.818   0.946  0.00  0.00    -0.166 F 
ATOM     34  F   LIG    1       -5.389   0.151   0.912  0.00  0.00    -0.166 F 
ATOM     35  F   LIG    1       -5.751  -0.921  -0.951  0.00  0.00    -0.166 F 
ENDBRANCH  28  32
TORSDOF 1