REMARK  Name = BDB052984
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.538   0.909   0.085  0.00  0.00    +0.152 A 
ATOM      2  C   LIG    1       -0.099   2.064   0.786  0.00  0.00    +0.029 A 
ATOM      3  C   LIG    1       -1.424   2.358   0.478  0.00  0.00    +0.051 A 
ATOM      4  C   LIG    1       -2.080   3.432   1.099  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1       -1.408   4.217   2.033  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -0.084   3.930   2.349  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -2.150   1.534  -0.501  0.00  0.00    +0.275 A 
ATOM      8  O   LIG    1       -3.316   1.810  -0.772  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1       -1.445   0.475  -1.059  0.00  0.00    -0.227 N 
ATOM     10  C   LIG    1        0.572   2.859   1.731  0.00  0.00    +0.012 A 
ATOM     11  N   LIG    1       -0.137   0.192  -0.776  0.00  0.00    -0.152 NA
ENDROOT
BRANCH   1  12
ATOM     12  N   LIG    1        1.869   0.591   0.350  0.00  0.00    -0.283 N 
ATOM     13  H   LIG    1        2.358   1.176   1.014  0.00  0.00    +0.155 HD
BRANCH  12  19
ATOM     14  C   LIG    1        5.321  -2.748  -0.996  0.00  0.00    +0.067 C 
ATOM     15  C   LIG    1        4.097  -1.932  -0.820  0.00  0.00    +0.062 A 
ATOM     16  N   LIG    1        2.987  -2.229  -1.507  0.00  0.00    -0.178 NA
ATOM     17  N   LIG    1        2.103  -1.298  -1.103  0.00  0.00    -0.264 N 
ATOM     18  H   LIG    1        1.160  -1.294  -1.480  0.00  0.00    +0.190 HD
ATOM     19  C   LIG    1        2.608  -0.420  -0.181  0.00  0.00    +0.120 A 
ATOM     20  C   LIG    1        3.910  -0.808   0.022  0.00  0.00    +0.068 A 
ENDBRANCH  12  19
ENDBRANCH   1  12
BRANCH   9  21
ATOM     21  C   LIG    1       -2.093  -0.401  -2.034  0.00  0.00    +0.150 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -2.695  -1.692  -1.443  0.00  0.00    +0.004 C 
ATOM     23  C   LIG    1       -3.794  -1.417  -0.418  0.00  0.00    +0.009 C 
ATOM     24  C   LIG    1       -1.633  -2.618  -0.849  0.00  0.00    +0.009 C 
ENDBRANCH  21  22
ENDBRANCH   9  21
TORSDOF 4