REMARK  Name = BDB061796
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.467  -1.811  -0.263  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.455  -2.037   1.110  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.698  -2.082   1.794  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.647  -2.216   1.803  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.863  -2.181   1.116  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        2.898  -1.973  -0.274  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1        1.684  -1.809  -0.959  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  13
ATOM      8  C   LIG    1       -5.018   1.616   0.779  0.00  0.00    +0.216 C 
ATOM      9  N   LIG    1       -3.934   0.828   0.395  0.00  0.00    -0.295 N 
ATOM     10  C   LIG    1       -4.210  -0.349  -0.468  0.00  0.00    +0.093 C 
ATOM     11  C   LIG    1       -2.999  -0.671  -1.372  0.00  0.00    +0.130 C 
ATOM     12  N   LIG    1       -1.749  -0.750  -0.613  0.00  0.00    -0.294 N 
ATOM     13  C   LIG    1       -0.785  -1.662  -1.030  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1       -0.911  -2.366  -2.031  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1       -1.469   0.441   0.193  0.00  0.00    +0.127 C 
ATOM     16  C   LIG    1       -2.646   0.811   1.106  0.00  0.00    +0.127 C 
ATOM     17  O   LIG    1       -6.142   1.455   0.302  0.00  0.00    -0.276 OA
BRANCH   8  19
ATOM     18  C   LIG    1       -5.992   3.510   2.143  0.00  0.00    +0.013 C 
ATOM     19  C   LIG    1       -4.746   2.706   1.805  0.00  0.00    +0.092 C 
ENDBRANCH   8  19
BRANCH  10  20
ATOM     20  C   LIG    1       -4.648  -1.552   0.398  0.00  0.00    +0.021 C 
ATOM     21  C   LIG    1       -5.192  -2.720  -0.412  0.00  0.00    +0.006 C 
ENDBRANCH  10  20
ENDBRANCH   1  13
BRANCH   6  22
ATOM     22  C   LIG    1        4.218  -1.960  -1.022  0.00  0.00    +0.162 C 
BRANCH  22  23
ATOM     23  N   LIG    1        5.093  -0.852  -0.628  0.00  0.00    -0.289 N 
ATOM     24  C   LIG    1        4.909   0.466  -1.151  0.00  0.00    +0.059 A 
ATOM     25  C   LIG    1        5.719   1.510  -0.690  0.00  0.00    +0.063 A 
ATOM     26  C   LIG    1        5.569   2.822  -1.161  0.00  0.00    +0.015 A 
ATOM     27  C   LIG    1        4.600   3.108  -2.116  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1        3.791   2.084  -2.597  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        6.757   1.223   0.311  0.00  0.00    +0.262 A 
ATOM     30  O   LIG    1        7.465   2.103   0.785  0.00  0.00    -0.267 OA
ATOM     31  N   LIG    1        6.881  -0.085   0.684  0.00  0.00    -0.274 N 
ATOM     32  H   LIG    1        7.581  -0.293   1.380  0.00  0.00    +0.173 HD
ATOM     33  C   LIG    1        3.944   0.776  -2.121  0.00  0.00    +0.027 A 
ATOM     34  C   LIG    1        6.085  -1.126   0.304  0.00  0.00    +0.330 A 
ATOM     35  O   LIG    1        6.272  -2.233   0.805  0.00  0.00    -0.246 OA
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 5