REMARK  Name = BDB042506
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.073   0.551   0.067  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.268   0.658  -0.886  0.00  0.00    +0.054 C 
BRANCH   2  10
ATOM      3  C   LIG    1       -7.010   1.585   1.359  0.00  0.00    +0.044 C 
ATOM      4  C   LIG    1       -6.837   0.104   1.146  0.00  0.00    -0.042 A 
ATOM      5  C   LIG    1       -5.671  -0.444   0.565  0.00  0.00    -0.005 A 
ATOM      6  C   LIG    1       -5.575  -1.842   0.397  0.00  0.00    +0.082 A 
ATOM      7  C   LIG    1       -4.350  -2.415  -0.213  0.00  0.00    +0.259 A 
ATOM      8  N   LIG    1       -3.370  -1.516  -0.575  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1       -2.546  -1.936  -0.988  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1       -3.446  -0.155  -0.411  0.00  0.00    +0.020 A 
ATOM     11  O   LIG    1       -4.187  -3.614  -0.400  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -6.620  -2.672   0.798  0.00  0.00    +0.136 A 
ATOM     13  F   LIG    1       -6.560  -4.003   0.652  0.00  0.00    -0.205 F 
ATOM     14  C   LIG    1       -7.768  -2.134   1.369  0.00  0.00    +0.039 A 
ATOM     15  C   LIG    1       -4.544   0.396   0.127  0.00  0.00    +0.030 A 
ATOM     16  C   LIG    1       -7.877  -0.756   1.542  0.00  0.00    +0.007 A 
ENDBRANCH   2  10
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1        0.112   1.379  -0.449  0.00  0.00    +0.085 C 
BRANCH  17  18
ATOM     18  N   LIG    1        1.239   1.373   0.491  0.00  0.00    -0.299 NA
ATOM     19  C   LIG    1        2.139   2.520   0.241  0.00  0.00    +0.103 C 
ATOM     20  C   LIG    1        3.533   2.348   0.863  0.00  0.00    +0.123 C 
ATOM     21  N   LIG    1        4.221   1.175   0.324  0.00  0.00    -0.295 N 
ATOM     22  C   LIG    1        5.599   1.092   0.484  0.00  0.00    +0.247 C 
ATOM     23  O   LIG    1        6.255   1.919   1.113  0.00  0.00    -0.270 OA
ATOM     24  C   LIG    1        3.358   0.085  -0.144  0.00  0.00    +0.123 C 
ATOM     25  C   LIG    1        1.973   0.091   0.538  0.00  0.00    +0.103 C 
BRANCH  22  26
ATOM     26  C   LIG    1        6.324  -0.043  -0.131  0.00  0.00    +0.037 A 
ATOM     27  C   LIG    1        7.166  -0.818   0.672  0.00  0.00    +0.013 A 
ATOM     28  C   LIG    1        7.871  -1.883   0.110  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        7.745  -2.160  -1.253  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.924  -1.370  -2.059  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1        6.217  -0.304  -1.502  0.00  0.00    +0.013 A 
ENDBRANCH  22  26
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 5