REMARK  Name = BDB017199
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.711  -1.631  -2.104  0.00  0.00    -0.290 OA
ATOM      2  C   LIG    1        1.456  -1.226  -0.969  0.00  0.00    +0.185 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        2.456  -0.379  -0.251  0.00  0.00    +0.107 A 
ATOM      4  N   LIG    1        2.106   0.073   0.977  0.00  0.00    -0.244 NA
ATOM      5  C   LIG    1        2.986   0.841   1.642  0.00  0.00    +0.072 A 
ATOM      6  C   LIG    1        4.246   1.187   1.107  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1        5.130   1.994   1.844  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1        4.772   2.459   3.107  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        3.532   2.121   3.638  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        4.576   0.705  -0.165  0.00  0.00    +0.012 A 
ATOM     11  C   LIG    1        2.655   1.318   2.903  0.00  0.00    +0.028 A 
ATOM     12  C   LIG    1        3.670  -0.090  -0.858  0.00  0.00    +0.032 A 
ENDBRANCH   2   3
BRANCH   2  13
ATOM     13  C   LIG    1        0.138  -1.537  -0.264  0.00  0.00    +0.076 C 
ATOM     14  C   LIG    1       -0.824  -0.351  -0.431  0.00  0.00    +0.095 C 
ATOM     15  N   LIG    1       -2.127  -0.635   0.185  0.00  0.00    -0.301 NA
ATOM     16  C   LIG    1       -2.764  -1.821  -0.391  0.00  0.00    +0.084 C 
ATOM     17  C   LIG    1       -1.871  -3.050  -0.217  0.00  0.00    +0.016 C 
ATOM     18  C   LIG    1       -0.491  -2.820  -0.825  0.00  0.00    +0.014 C 
BRANCH  15  19
ATOM     19  C   LIG    1       -3.013   0.531   0.239  0.00  0.00    +0.088 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -3.484   1.040  -1.091  0.00  0.00    +0.003 C 
ATOM     21  C   LIG    1       -4.763   0.540  -1.717  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1       -4.701   1.931  -1.156  0.00  0.00    +0.005 C 
ENDBRANCH  19  20
ENDBRANCH  15  19
ENDBRANCH   2  13
TORSDOF 4