REMARK  Name = BDB013825
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.771   0.938  -0.032  0.00  0.00    +0.214 A 
ATOM      2  N   LIG    1        1.513   0.507   0.075  0.00  0.00    -0.200 NA
ATOM      3  C   LIG    1        1.183  -0.632  -0.557  0.00  0.00    +0.128 A 
ATOM      4  C   LIG    1        2.116  -1.337  -1.294  0.00  0.00    +0.063 A 
ATOM      5  C   LIG    1        3.387  -0.819  -1.330  0.00  0.00    +0.118 A 
ATOM      6  N   LIG    1        3.742   0.309  -0.696  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        3.106   2.096   0.638  0.00  0.00    -0.327 N 
ATOM      8  H   LIG    1        2.465   2.235   1.407  0.00  0.00    +0.145 HD
ATOM      9  H   LIG    1        4.094   2.091   0.850  0.00  0.00    +0.145 HD
ENDBRANCH   1   7
BRANCH   3  10
ATOM     10  N   LIG    1       -0.136  -1.149  -0.508  0.00  0.00    -0.299 N 
ATOM     11  H   LIG    1       -0.110  -2.135  -0.278  0.00  0.00    +0.154 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -1.310  -0.532  -0.020  0.00  0.00    +0.032 A 
ATOM     13  C   LIG    1       -1.494   0.855  -0.007  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1       -2.698   1.421   0.426  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.748   0.604   0.832  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -3.599  -0.779   0.793  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1       -2.394  -1.341   0.360  0.00  0.00    +0.023 A 
ENDBRANCH  10  12
ENDBRANCH   3  10
TORSDOF 3