REMARK  Name = BDB064222
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.171  -0.709  -1.018  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -1.458  -1.775  -1.867  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.789  -1.948  -3.015  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -2.450  -2.693  -1.534  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -3.181  -2.532  -0.354  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.940  -1.438   0.493  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1       -1.919  -0.534   0.154  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  13
ATOM      8  N   LIG    1        3.625  -0.014  -0.458  0.00  0.00    -0.298 N 
ATOM      9  C   LIG    1        2.966  -1.246  -0.481  0.00  0.00    +0.233 C 
ATOM     10  O   LIG    1        3.396  -2.238   0.113  0.00  0.00    -0.274 OA
ATOM     11  C   LIG    1        1.734  -1.385  -1.404  0.00  0.00    +0.204 C 
ATOM     12  N   LIG    1        1.114  -0.118  -1.797  0.00  0.00    -0.287 N 
ATOM     13  C   LIG    1       -0.141   0.295  -1.358  0.00  0.00    +0.250 C 
ATOM     14  O   LIG    1       -0.446   1.481  -1.238  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        2.078   0.906  -2.168  0.00  0.00    +0.127 C 
ATOM     16  C   LIG    1        2.966   1.197  -0.963  0.00  0.00    +0.127 C 
BRANCH   8  17
ATOM     17  C   LIG    1        4.792   0.158   0.409  0.00  0.00    +0.114 C 
BRANCH  17  19
ATOM     18  C   LIG    1        7.272   0.203   0.752  0.00  0.00    +0.012 C 
ATOM     19  C   LIG    1        6.165  -0.008  -0.300  0.00  0.00    -0.022 C 
ATOM     20  C   LIG    1        6.352   1.032  -1.416  0.00  0.00    +0.012 C 
ATOM     21  C   LIG    1        6.326  -1.415  -0.899  0.00  0.00    +0.012 C 
ENDBRANCH  17  19
ENDBRANCH   8  17
ENDBRANCH   1  13
BRANCH   6  22
ATOM     22  C   LIG    1       -3.739  -1.269   1.772  0.00  0.00    +0.162 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -4.290   0.075   1.953  0.00  0.00    -0.289 N 
ATOM     24  C   LIG    1       -5.449   0.505   1.235  0.00  0.00    +0.059 A 
ATOM     25  C   LIG    1       -5.936   1.804   1.425  0.00  0.00    +0.063 A 
ATOM     26  C   LIG    1       -7.070   2.270   0.746  0.00  0.00    +0.015 A 
ATOM     27  C   LIG    1       -7.738   1.434  -0.141  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -7.272   0.139  -0.345  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1       -5.242   2.700   2.361  0.00  0.00    +0.262 A 
ATOM     30  O   LIG    1       -5.627   3.846   2.566  0.00  0.00    -0.267 OA
ATOM     31  N   LIG    1       -4.149   2.176   2.991  0.00  0.00    -0.274 N 
ATOM     32  H   LIG    1       -3.660   2.783   3.630  0.00  0.00    +0.173 HD
ATOM     33  C   LIG    1       -6.139  -0.322   0.337  0.00  0.00    +0.027 A 
ATOM     34  C   LIG    1       -3.634   0.921   2.836  0.00  0.00    +0.330 A 
ATOM     35  O   LIG    1       -2.628   0.606   3.471  0.00  0.00    -0.246 OA
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 5