REMARK  Name = BDB013854
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.681   0.281   0.171  0.00  0.00    -0.338 N 
ATOM      2  H   LIG    1       -0.615  -0.582  -0.389  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   4
ATOM      3  C   LIG    1       -3.031  -0.414   0.452  0.00  0.00    +0.082 A 
ATOM      4  C   LIG    1       -2.028   0.579   0.459  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -2.441   1.831   0.924  0.00  0.00    +0.134 A 
ATOM      6  N   LIG    1       -3.704   2.158   1.293  0.00  0.00    -0.261 NA
ATOM      7  C   LIG    1       -4.627   1.182   1.238  0.00  0.00    +0.111 A 
ATOM      8  C   LIG    1       -4.344  -0.106   0.834  0.00  0.00    +0.036 A 
BRANCH   3  10
ATOM      9  O   LIG    1       -1.696  -2.141  -0.574  0.00  0.00    -0.245 OA
ATOM     10  C   LIG    1       -2.714  -1.793  -0.004  0.00  0.00    +0.339 C 
BRANCH  10  11
ATOM     11  O   LIG    1       -3.688  -2.679   0.275  0.00  0.00    -0.477 OA
ATOM     12  H   LIG    1       -3.337  -3.530  -0.067  0.00  0.00    +0.295 HD
ENDBRANCH  10  11
ENDBRANCH   3  10
ENDBRANCH   1   4
BRANCH   1  13
ATOM     13  C   LIG    1        0.151   1.332  -0.419  0.00  0.00    +0.139 C 
BRANCH  13  14
ATOM     14  C   LIG    1        1.527   0.797  -0.748  0.00  0.00    -0.007 A 
ATOM     15  C   LIG    1        2.246  -0.094   0.074  0.00  0.00    +0.051 A 
ATOM     16  C   LIG    1        3.539  -0.533  -0.206  0.00  0.00    -0.000 A 
ATOM     17  C   LIG    1        3.922  -1.414   0.844  0.00  0.00    +0.027 A 
ATOM     18  C   LIG    1        2.871  -1.499   1.728  0.00  0.00    +0.083 A 
ATOM     19  C   LIG    1        4.175  -0.068  -1.371  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1        3.498   0.823  -2.208  0.00  0.00    +0.001 A 
ATOM     21  N   LIG    1        1.866  -0.702   1.254  0.00  0.00    -0.360 N 
ATOM     22  H   LIG    1        0.949  -0.582   1.668  0.00  0.00    +0.165 HD
ATOM     23  C   LIG    1        2.207   1.250  -1.897  0.00  0.00    +0.007 A 
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 5