REMARK  Name = BDB055708
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.502   0.661   1.659  0.00  0.00    -0.041 A 
ATOM      2  C   LIG    1       -1.455   0.208   0.841  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -0.351   1.032   0.595  0.00  0.00    +0.072 A 
ATOM      4  C   LIG    1       -0.290   2.309   1.145  0.00  0.00    +0.135 A 
ATOM      5  F   LIG    1        0.755   3.113   0.905  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1       -1.310   2.762   1.975  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1       -2.408   1.938   2.238  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1        0.700   0.566  -0.319  0.00  0.00    +0.250 C 
ATOM      9  N   LIG    1        1.974   0.293   0.171  0.00  0.00    -0.289 N 
ATOM     10  C   LIG    1        3.017  -0.060  -0.808  0.00  0.00    +0.125 C 
ATOM     11  C   LIG    1        2.819  -1.450  -1.447  0.00  0.00    +0.131 C 
ATOM     12  N   LIG    1        3.868  -1.742  -2.408  0.00  0.00    -0.309 N 
ATOM     13  H   LIG    1        3.699  -2.393  -3.165  0.00  0.00    +0.149 HD
ATOM     14  C   LIG    1        5.188  -1.434  -2.179  0.00  0.00    +0.244 C 
ATOM     15  C   LIG    1        5.482  -0.599  -0.980  0.00  0.00    +0.042 A 
ATOM     16  C   LIG    1        6.807  -0.455  -0.557  0.00  0.00    +0.013 A 
ATOM     17  C   LIG    1        7.095   0.274   0.597  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        6.061   0.839   1.344  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        4.730   0.692   0.935  0.00  0.00    -0.040 A 
ATOM     20  C   LIG    1        3.598   1.241   1.762  0.00  0.00    +0.054 C 
ATOM     21  O   LIG    1        6.074  -1.845  -2.916  0.00  0.00    -0.270 OA
ATOM     22  C   LIG    1        4.436   0.006  -0.258  0.00  0.00    -0.010 A 
ATOM     23  C   LIG    1        2.368   0.349   1.581  0.00  0.00    +0.113 C 
ATOM     24  O   LIG    1        0.382   0.415  -1.496  0.00  0.00    -0.270 OA
ENDBRANCH   3   8
BRANCH   1  25
ATOM     25  C   LIG    1       -3.695  -0.218   1.966  0.00  0.00    +0.092 C 
BRANCH  25  35
ATOM     26  C   LIG    1       -5.272   1.212  -0.133  0.00  0.00    +0.046 C 
ATOM     27  C   LIG    1       -5.003  -0.252  -0.310  0.00  0.00    -0.019 A 
ATOM     28  C   LIG    1       -5.406  -0.988  -1.365  0.00  0.00    +0.020 A 
ATOM     29  C   LIG    1       -6.134  -0.484  -2.578  0.00  0.00    +0.050 C 
ATOM     30  C   LIG    1       -5.120  -2.452  -1.397  0.00  0.00    +0.268 A 
ATOM     31  O   LIG    1       -5.494  -3.165  -2.323  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -4.428  -2.958  -0.334  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1       -4.227  -3.953  -0.347  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1       -3.978  -2.255   0.734  0.00  0.00    -0.175 NA
ATOM     35  C   LIG    1       -4.239  -0.983   0.760  0.00  0.00    +0.069 A 
ENDBRANCH  25  35
ENDBRANCH   1  25
TORSDOF 3