REMARK  Name = BDB003834
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.351  -1.603   1.630  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -4.379  -1.311   0.935  0.00  0.00    +0.219 C 
ATOM      3  N   LIG    1       -3.126  -1.342   1.480  0.00  0.00    -0.256 N 
ATOM      4  H   LIG    1       -3.324  -1.610   2.442  0.00  0.00    +0.157 HD
ATOM      5  C   LIG    1       -2.471  -0.146   1.575  0.00  0.00    +0.227 C 
ATOM      6  O   LIG    1       -2.495   0.473   2.637  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -1.614   0.274   0.386  0.00  0.00    +0.064 C 
ATOM      8  C   LIG    1       -0.234  -0.395   0.542  0.00  0.00    +0.122 C 
ATOM      9  N   LIG    1        0.663   0.494  -0.192  0.00  0.00    -0.314 N 
ATOM     10  C   LIG    1        0.147   1.857  -0.219  0.00  0.00    +0.107 C 
ATOM     11  C   LIG    1       -1.222   1.766   0.464  0.00  0.00    +0.036 C 
ATOM     12  C   LIG    1       -2.232  -0.065  -0.988  0.00  0.00    +0.018 C 
ATOM     13  C   LIG    1       -3.736   0.182  -1.053  0.00  0.00    +0.010 C 
ATOM     14  C   LIG    1       -4.523  -1.016  -0.540  0.00  0.00    +0.096 C 
ENDROOT
BRANCH   9  15
ATOM     15  C   LIG    1        2.013   0.217  -0.181  0.00  0.00    +0.121 A 
ATOM     16  N   LIG    1        2.426  -0.938   0.388  0.00  0.00    -0.240 NA
ATOM     17  C   LIG    1        3.747  -1.235   0.390  0.00  0.00    +0.125 A 
ATOM     18  C   LIG    1        4.723  -0.434  -0.174  0.00  0.00    +0.073 A 
ATOM     19  C   LIG    1        4.300   0.752  -0.767  0.00  0.00    +0.017 A 
ATOM     20  C   LIG    1        2.940   1.072  -0.775  0.00  0.00    +0.044 A 
BRANCH  18  21
ATOM     21  C   LIG    1        6.161  -0.837  -0.105  0.00  0.00    +0.419 C 
ATOM     22  F   LIG    1        6.732  -0.524   1.090  0.00  0.00    -0.166 F 
ATOM     23  F   LIG    1        6.347  -2.176  -0.268  0.00  0.00    -0.166 F 
ATOM     24  F   LIG    1        6.933  -0.239  -1.055  0.00  0.00    -0.166 F 
ENDBRANCH  18  21
ENDBRANCH   9  15
TORSDOF 2