REMARK  Name = BDB028220
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.736   0.492   0.410  0.00  0.00    +0.083 A 
ATOM      2  C   LIG    1       -1.504  -0.214  -0.023  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -1.659  -1.292  -0.890  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -0.544  -2.003  -1.342  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1        0.735  -1.629  -0.923  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        0.920  -0.545  -0.049  0.00  0.00    -0.016 A 
ATOM      7  C   LIG    1       -3.010  -1.675  -1.328  0.00  0.00    +0.272 A 
ATOM      8  O   LIG    1       -3.189  -2.617  -2.092  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1       -4.042  -0.918  -0.832  0.00  0.00    -0.242 N 
ATOM     10  H   LIG    1       -4.983  -1.167  -1.123  0.00  0.00    +0.192 HD
ATOM     11  C   LIG    1       -0.217   0.157   0.396  0.00  0.00    +0.019 A 
ATOM     12  N   LIG    1       -3.927   0.141   0.014  0.00  0.00    -0.174 NA
ENDROOT
BRANCH   6  13
ATOM     13  C   LIG    1        2.268  -0.153   0.387  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        3.282   0.145  -0.536  0.00  0.00    +0.057 A 
ATOM     15  C   LIG    1        4.541   0.519  -0.080  0.00  0.00    +0.135 A 
ATOM     16  C   LIG    1        4.765   0.588   1.284  0.00  0.00    +0.156 A 
ATOM     17  N   LIG    1        3.821   0.310   2.211  0.00  0.00    -0.259 NA
ATOM     18  C   LIG    1        2.604  -0.054   1.740  0.00  0.00    +0.119 A 
BRANCH  15  19
ATOM     19  O   LIG    1        5.555   0.821  -0.938  0.00  0.00    -0.505 OA
ATOM     20  H   LIG    1        5.238   0.731  -1.852  0.00  0.00    +0.292 HD
ENDBRANCH  15  19
ENDBRANCH   6  13
BRANCH   1  21
ATOM     21  C   LIG    1       -2.595   1.684   1.363  0.00  0.00    +0.136 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -3.907   2.253   1.694  0.00  0.00    -0.325 NA
ATOM     23  H   LIG    1       -4.486   1.498   2.071  0.00  0.00    +0.119 HD
ATOM     24  H   LIG    1       -4.375   2.481   0.814  0.00  0.00    +0.119 HD
ENDBRANCH  21  22
ENDBRANCH   1  21
TORSDOF 4