REMARK  Name = BDB055716
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.082   0.441  -0.487  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.037  -0.143  -1.749  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.858   0.264  -2.727  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.865  -1.167  -2.015  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.750  -1.591  -1.020  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.753  -0.978   0.243  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.821   0.037   0.505  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        0.486   2.612   0.153  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        1.003   1.549  -0.189  0.00  0.00    +0.250 C 
ATOM     10  N   LIG    1        2.379   1.352  -0.264  0.00  0.00    -0.290 N 
ATOM     11  C   LIG    1        3.031   0.047  -0.435  0.00  0.00    +0.110 C 
ATOM     12  C   LIG    1        2.749  -1.039   0.619  0.00  0.00    +0.069 C 
ATOM     13  C   LIG    1        3.950  -2.006   0.534  0.00  0.00    +0.199 C 
ATOM     14  C   LIG    1        5.061  -1.057   0.218  0.00  0.00    -0.009 A 
ATOM     15  C   LIG    1        6.427  -1.185   0.379  0.00  0.00    +0.007 A 
ATOM     16  C   LIG    1        7.237  -0.089   0.048  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        6.678   1.122  -0.405  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        5.298   1.239  -0.547  0.00  0.00    -0.041 A 
ATOM     19  C   LIG    1        4.556   2.491  -0.901  0.00  0.00    +0.054 C 
ATOM     20  F   LIG    1        4.083  -2.669   1.709  0.00  0.00    -0.240 F 
ATOM     21  C   LIG    1        4.525   0.123  -0.286  0.00  0.00    -0.018 A 
ATOM     22  C   LIG    1        3.242   2.539  -0.091  0.00  0.00    +0.113 C 
ENDBRANCH   1   9
BRANCH   6  23
ATOM     23  C   LIG    1       -2.721  -1.418   1.319  0.00  0.00    +0.093 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.170  -1.462   0.849  0.00  0.00    +0.074 A 
ATOM     25  C   LIG    1       -4.950  -0.205   0.716  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1       -6.265  -0.318   0.268  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1       -7.067   0.819   0.111  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1       -6.549   2.078   0.405  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -5.235   2.199   0.854  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1       -6.806  -1.651  -0.042  0.00  0.00    +0.272 A 
ATOM     31  O   LIG    1       -7.957  -1.799  -0.437  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -5.949  -2.708   0.139  0.00  0.00    -0.242 N 
ATOM     33  H   LIG    1       -6.309  -3.636  -0.067  0.00  0.00    +0.192 HD
ATOM     34  C   LIG    1       -4.435   1.063   1.012  0.00  0.00    +0.010 A 
ATOM     35  N   LIG    1       -4.663  -2.634   0.569  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   6  23
TORSDOF 3