REMARK  Name = BDB002820
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.003   0.789   1.451  0.00  0.00    -0.453 OA
ENDROOT
BRANCH   1   8
ATOM      2  C   LIG    1       -4.858  -0.970  -0.701  0.00  0.00    +0.176 C 
ATOM      3  N   LIG    1       -3.577  -0.477  -0.223  0.00  0.00    -0.231 N 
ATOM      4  C   LIG    1       -2.987   0.626  -0.838  0.00  0.00    +0.289 A 
ATOM      5  O   LIG    1       -3.479   1.202  -1.807  0.00  0.00    -0.265 OA
ATOM      6  C   LIG    1       -1.692   1.079  -0.251  0.00  0.00    +0.150 A 
ATOM      7 CL   LIG    1       -0.917   2.435  -0.990  0.00  0.00    -0.074 Cl
ATOM      8  C   LIG    1       -1.168   0.448   0.806  0.00  0.00    +0.172 A 
ATOM      9  C   LIG    1       -1.979  -0.631   1.387  0.00  0.00    +0.180 A 
ATOM     10  N   LIG    1       -3.096  -1.077   0.918  0.00  0.00    -0.173 NA
ENDBRANCH   1   8
BRANCH   1  11
ATOM     11  C   LIG    1        1.201   0.468   0.852  0.00  0.00    +0.129 A 
ATOM     12  C   LIG    1        2.290   1.268   1.212  0.00  0.00    +0.048 A 
ATOM     13  C   LIG    1        3.556   1.022   0.675  0.00  0.00    +0.036 A 
ATOM     14  C   LIG    1        3.728  -0.039  -0.222  0.00  0.00    +0.126 A 
ATOM     15  C   LIG    1        2.644  -0.854  -0.576  0.00  0.00    +0.036 A 
ATOM     16  C   LIG    1        1.380  -0.601  -0.033  0.00  0.00    +0.048 A 
BRANCH  14  17
ATOM     17  N   LIG    1        5.056  -0.306  -0.790  0.00  0.00    +0.056 N 
ATOM     18  O   LIG    1        5.167  -1.260  -1.573  0.00  0.00    -0.126 OA
ATOM     19  O   LIG    1        5.988   0.437  -0.450  0.00  0.00    -0.126 OA
ENDBRANCH  14  17
ENDBRANCH   1  11
TORSDOF 3