REMARK  Name = BDB051873
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.235   0.246  -0.615  0.00  0.00    +0.139 A 
ATOM      2  O   LIG    1       -0.670  -0.786   0.099  0.00  0.00    -0.455 OA
ATOM      3  C   LIG    1        0.690  -0.780   0.290  0.00  0.00    +0.140 A 
ATOM      4  C   LIG    1        1.185  -1.852   1.025  0.00  0.00    +0.047 A 
ATOM      5  C   LIG    1        2.548  -1.946   1.279  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1        3.437  -0.972   0.805  0.00  0.00    -0.017 A 
ATOM      7  C   LIG    1        2.956   0.135   0.051  0.00  0.00    -0.004 A 
ATOM      8  C   LIG    1        3.932   1.070  -0.385  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1        5.292   0.923  -0.097  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        5.730  -0.166   0.639  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        4.806  -1.106   1.087  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1        1.550   0.212  -0.201  0.00  0.00    +0.072 A 
ATOM     13  C   LIG    1        0.913   1.314  -0.976  0.00  0.00    +0.194 A 
ATOM     14  O   LIG    1        1.519   2.251  -1.479  0.00  0.00    -0.287 OA
ATOM     15  C   LIG    1       -0.549   1.264  -1.144  0.00  0.00    +0.098 A 
ENDROOT
BRANCH   1  18
ATOM     16  C   LIG    1       -3.041   0.476   1.752  0.00  0.00    +0.044 C 
ATOM     17  C   LIG    1       -3.562   0.271   0.355  0.00  0.00    -0.040 A 
ATOM     18  C   LIG    1       -2.698   0.163  -0.755  0.00  0.00    +0.020 A 
ATOM     19  C   LIG    1       -3.242  -0.038  -2.035  0.00  0.00    +0.012 A 
ATOM     20  C   LIG    1       -4.622  -0.134  -2.217  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1       -5.474  -0.034  -1.122  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -4.948   0.163   0.155  0.00  0.00    +0.004 A 
ENDBRANCH   1  18
TORSDOF 1