REMARK  Name = BDB025308
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.094  -0.276   0.300  0.00  0.00    -0.312 N 
ATOM      2  C   LIG    1       -0.851   0.685  -0.327  0.00  0.00    +0.142 A 
ATOM      3  C   LIG    1       -2.185   0.309  -0.239  0.00  0.00    +0.027 A 
ATOM      4  C   LIG    1       -3.138   1.169  -0.812  0.00  0.00    +0.013 A 
ATOM      5  C   LIG    1       -2.678   2.333  -1.426  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1       -1.314   2.585  -1.450  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1       -2.226  -0.939   0.452  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1       -3.263  -1.805   0.828  0.00  0.00    +0.030 A 
ATOM      9  C   LIG    1       -2.897  -2.962   1.494  0.00  0.00    +0.111 A 
ATOM     10  N   LIG    1       -1.628  -3.302   1.799  0.00  0.00    -0.261 NA
ATOM     11  C   LIG    1       -0.621  -2.471   1.450  0.00  0.00    +0.137 A 
ATOM     12  N   LIG    1       -0.356   1.791  -0.921  0.00  0.00    -0.237 NA
ATOM     13  C   LIG    1       -0.909  -1.289   0.773  0.00  0.00    +0.070 A 
ENDROOT
BRANCH   1  20
ATOM     14  O   LIG    1        4.991   1.576  -0.467  0.00  0.00    -0.275 OA
ATOM     15  C   LIG    1        3.889   1.067  -0.289  0.00  0.00    +0.219 C 
ATOM     16  N   LIG    1        2.951   1.665   0.512  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1        3.251   2.517   0.967  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1        1.835   1.071   1.055  0.00  0.00    +0.242 C 
ATOM     19  O   LIG    1        1.333   1.530   2.080  0.00  0.00    -0.273 OA
ATOM     20  C   LIG    1        1.363  -0.224   0.401  0.00  0.00    +0.176 C 
ATOM     21  C   LIG    1        2.028  -0.457  -0.960  0.00  0.00    +0.044 C 
ATOM     22  C   LIG    1        3.533  -0.294  -0.837  0.00  0.00    +0.099 C 
ENDBRANCH   1  20
TORSDOF 1