REMARK  Name = BDB051656
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.025  -1.922  -0.535  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -3.860  -1.554  -0.460  0.00  0.00    +0.244 C 
ATOM      3  C   LIG    1       -3.489  -0.208   0.060  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1       -2.141   0.118   0.301  0.00  0.00    -0.010 A 
ATOM      5  C   LIG    1       -1.810   1.428   0.687  0.00  0.00    -0.040 A 
ATOM      6  C   LIG    1       -0.361   1.797   0.841  0.00  0.00    +0.054 C 
ATOM      7  C   LIG    1        0.473   0.971  -0.139  0.00  0.00    +0.113 C 
ATOM      8  N   LIG    1        0.311  -0.465   0.108  0.00  0.00    -0.292 N 
ATOM      9  C   LIG    1        1.325  -1.386   0.317  0.00  0.00    +0.220 C 
ATOM     10  O   LIG    1        1.048  -2.569   0.558  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1       -2.824   2.370   0.906  0.00  0.00    +0.004 A 
ATOM     12  C   LIG    1       -4.160   2.025   0.704  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -1.078  -0.967   0.185  0.00  0.00    +0.124 C 
ATOM     14  C   LIG    1       -1.463  -1.880  -0.998  0.00  0.00    +0.131 C 
ATOM     15  C   LIG    1       -4.494   0.742   0.270  0.00  0.00    +0.013 A 
ATOM     16  N   LIG    1       -2.828  -2.361  -0.874  0.00  0.00    -0.309 N 
ATOM     17  H   LIG    1       -3.107  -3.227  -1.318  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   9  18
ATOM     18  C   LIG    1        2.801  -1.013   0.262  0.00  0.00    +0.090 C 
ATOM     19  C   LIG    1        3.261  -0.026   1.329  0.00  0.00    +0.093 C 
ATOM     20  N   LIG    1        3.956   1.045   0.603  0.00  0.00    -0.315 NA
ATOM     21  H   LIG    1        4.730   1.414   1.156  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1        4.444   0.450  -0.640  0.00  0.00    +0.081 C 
ATOM     23  C   LIG    1        3.312  -0.468  -1.064  0.00  0.00    +0.029 C 
ENDBRANCH   9  18
TORSDOF 1