REMARK  Name = BDB000738
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.876  -0.025  -0.569  0.00  0.00    +0.159 A 
ATOM      2  N   LIG    1        1.148  -0.981  -1.224  0.00  0.00    -0.337 N 
ATOM      3  H   LIG    1        1.534  -1.603  -1.919  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1       -0.144  -0.928  -0.769  0.00  0.00    +0.068 A 
ATOM      5  C   LIG    1       -0.124   0.102   0.176  0.00  0.00    +0.090 A 
ATOM      6  C   LIG    1       -1.301   0.449   0.865  0.00  0.00    +0.036 A 
ATOM      7  C   LIG    1       -2.447  -0.277   0.555  0.00  0.00    -0.010 A 
ATOM      8  C   LIG    1       -3.849  -0.148   1.114  0.00  0.00    +0.068 C 
ATOM      9  C   LIG    1       -3.895  -0.457   2.609  0.00  0.00    +0.025 C 
ATOM     10  C   LIG    1       -4.463   1.215   0.799  0.00  0.00    +0.025 C 
ATOM     11  C   LIG    1       -4.598  -1.252   0.329  0.00  0.00    +0.227 C 
ATOM     12  O   LIG    1       -5.777  -1.552   0.422  0.00  0.00    -0.275 OA
ATOM     13  N   LIG    1       -3.681  -1.859  -0.520  0.00  0.00    -0.284 N 
ATOM     14  H   LIG    1       -3.933  -2.614  -1.139  0.00  0.00    +0.155 HD
ATOM     15  C   LIG    1       -2.420  -1.298  -0.397  0.00  0.00    +0.040 A 
ATOM     16  C   LIG    1       -1.284  -1.670  -1.097  0.00  0.00    +0.051 A 
ATOM     17  N   LIG    1        1.132   0.647   0.285  0.00  0.00    -0.226 NA
ENDROOT
BRANCH   1  23
ATOM     18  C   LIG    1        6.749   1.665  -0.537  0.00  0.00    +0.065 C 
ATOM     19  C   LIG    1        5.458   0.980  -0.764  0.00  0.00    +0.034 A 
ATOM     20  N   LIG    1        5.317  -0.041  -1.664  0.00  0.00    -0.281 N 
ATOM     21  H   LIG    1        6.029  -0.448  -2.262  0.00  0.00    +0.189 HD
ATOM     22  N   LIG    1        4.069  -0.538  -1.730  0.00  0.00    -0.171 NA
ATOM     23  C   LIG    1        3.392   0.199  -0.838  0.00  0.00    +0.128 A 
ATOM     24  C   LIG    1        4.210   1.158  -0.209  0.00  0.00    +0.055 A 
ENDBRANCH   1  23
TORSDOF 1