REMARK  Name = BDB026381
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.874  -3.084   1.688  0.00  0.00    +0.154 C 
ATOM      2  N   LIG    1        0.457  -1.839   1.112  0.00  0.00    -0.295 N 
ATOM      3  C   LIG    1        1.311  -0.875   0.563  0.00  0.00    +0.070 A 
ATOM      4  C   LIG    1        0.522   0.152   0.041  0.00  0.00    +0.071 A 
ATOM      5  C   LIG    1        1.088   1.244  -0.582  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        2.486   1.287  -0.667  0.00  0.00    +0.007 A 
ATOM      7  C   LIG    1        3.292   0.245  -0.144  0.00  0.00    -0.032 A 
ATOM      8  N   LIG    1       -0.824  -0.175   0.278  0.00  0.00    -0.280 N 
ATOM      9  C   LIG    1        2.689  -0.855   0.489  0.00  0.00    +0.033 A 
ATOM     10  C   LIG    1       -0.877  -1.437   0.915  0.00  0.00    +0.331 A 
ATOM     11  O   LIG    1       -1.885  -2.051   1.226  0.00  0.00    -0.246 OA
ENDROOT
BRANCH   8  12
ATOM     12  C   LIG    1       -1.978   0.572  -0.173  0.00  0.00    +0.179 C 
ATOM     13  C   LIG    1       -2.637  -0.137  -1.364  0.00  0.00    +0.242 C 
ATOM     14  O   LIG    1       -2.018  -0.789  -2.204  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1       -3.986   0.093  -1.530  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1       -4.409  -0.349  -2.335  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1       -4.798   0.923  -0.801  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1       -5.958   1.135  -1.143  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -4.166   1.625   0.378  0.00  0.00    +0.099 C 
ATOM     20  C   LIG    1       -3.001   0.824   0.936  0.00  0.00    +0.044 C 
ENDBRANCH   8  12
BRANCH   7  21
ATOM     21  C   LIG    1        4.795   0.335  -0.234  0.00  0.00    +0.113 C 
BRANCH  21  22
ATOM     22  N   LIG    1        5.352   1.015   0.928  0.00  0.00    -0.326 NA
ATOM     23  H   LIG    1        4.935   1.942   1.001  0.00  0.00    +0.119 HD
ATOM     24  H   LIG    1        5.068   0.518   1.771  0.00  0.00    +0.119 HD
ENDBRANCH  21  22
ENDBRANCH   7  21
TORSDOF 3