REMARK  Name = BDB055859
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.132  -0.195  -0.857  0.00  0.00    +0.113 A 
ATOM      2  N   LIG    1        1.562  -1.018  -1.870  0.00  0.00    -0.340 N 
ATOM      3  H   LIG    1        1.030  -1.270  -2.691  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1        2.835  -1.433  -1.579  0.00  0.00    +0.085 A 
ATOM      5  C   LIG    1        3.139  -0.825  -0.366  0.00  0.00    +0.104 A 
ATOM      6  C   LIG    1        4.393  -1.051   0.213  0.00  0.00    +0.082 A 
ATOM      7  C   LIG    1        5.244  -1.889  -0.498  0.00  0.00    +0.126 A 
ATOM      8  N   LIG    1        4.939  -2.481  -1.685  0.00  0.00    -0.260 NA
ATOM      9  C   LIG    1        3.727  -2.260  -2.243  0.00  0.00    +0.138 A 
ATOM     10  N   LIG    1        2.068  -0.060   0.061  0.00  0.00    -0.231 NA
ENDROOT
BRANCH   1  13
ATOM     11  N   LIG    1       -2.121   1.072   0.693  0.00  0.00    -0.302 NA
ATOM     12  C   LIG    1       -0.986   0.165   0.454  0.00  0.00    +0.095 C 
ATOM     13  C   LIG    1       -0.226   0.442  -0.864  0.00  0.00    +0.069 C 
ATOM     14  C   LIG    1       -0.129   1.949  -1.111  0.00  0.00    +0.014 C 
ATOM     15  C   LIG    1       -1.515   2.604  -1.124  0.00  0.00    +0.016 C 
ATOM     16  C   LIG    1       -2.615   1.731  -0.508  0.00  0.00    +0.084 C 
BRANCH  11  17
ATOM     17  C   LIG    1       -3.158   0.504   1.556  0.00  0.00    +0.084 C 
BRANCH  17  19
ATOM     18  C   LIG    1       -5.080  -1.092   1.901  0.00  0.00    +0.005 C 
ATOM     19  C   LIG    1       -4.074  -0.539   0.901  0.00  0.00    +0.012 C 
ENDBRANCH  17  19
ENDBRANCH  11  17
ENDBRANCH   1  13
BRANCH   6  20
ATOM     20  C   LIG    1        4.820  -0.459   1.489  0.00  0.00    +0.245 C 
ATOM     21  O   LIG    1        5.928  -0.690   1.958  0.00  0.00    -0.270 OA
ATOM     22  N   LIG    1        3.934   0.358   2.131  0.00  0.00    -0.325 N 
ATOM     23  H   LIG    1        3.016   0.556   1.738  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1        4.201   0.785   3.006  0.00  0.00    +0.145 HD
ENDBRANCH   6  20
TORSDOF 4