REMARK  Name = BDB013679
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.198  -0.336   0.032  0.00  0.00    -0.325 N 
ATOM      2  H   LIG    1       -0.369   0.494   0.166  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.566  -0.157  -0.034  0.00  0.00    +0.147 A 
ATOM      4  C   LIG    1        2.178   1.017   0.644  0.00  0.00    +0.029 A 
ATOM      5  C   LIG    1        3.542   1.223   0.480  0.00  0.00    +0.051 A 
ATOM      6  C   LIG    1        4.169   2.325   1.081  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        3.427   3.213   1.857  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        2.063   2.999   2.042  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        4.331   0.265  -0.310  0.00  0.00    +0.275 A 
ATOM     10  O   LIG    1        5.529   0.472  -0.488  0.00  0.00    -0.266 OA
ATOM     11  N   LIG    1        3.646  -0.839  -0.801  0.00  0.00    -0.230 N 
ATOM     12  C   LIG    1        4.346  -1.826  -1.599  0.00  0.00    +0.176 C 
ATOM     13  C   LIG    1        1.437   1.902   1.441  0.00  0.00    +0.012 A 
ATOM     14  N   LIG    1        2.292  -1.016  -0.695  0.00  0.00    -0.153 NA
ENDBRANCH   1   3
BRANCH   1  15
ATOM     15  C   LIG    1       -0.482  -1.369  -0.755  0.00  0.00    +0.126 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -2.037  -1.387  -0.540  0.00  0.00    +0.103 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.732  -0.037  -0.832  0.00  0.00    -0.029 A 
ATOM     18  C   LIG    1       -3.942   0.307  -0.199  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1       -4.593   1.512  -0.476  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -4.061   2.393  -1.411  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -2.885   2.062  -2.077  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -2.234   0.856  -1.799  0.00  0.00    +0.005 A 
ENDBRANCH  16  17
BRANCH  16  24
ATOM     23  C   LIG    1       -2.375  -3.452   0.740  0.00  0.00    +0.105 C 
ATOM     24  N   LIG    1       -2.493  -1.994   0.745  0.00  0.00    -0.300 NA
ATOM     25  C   LIG    1       -1.853  -1.442   1.938  0.00  0.00    +0.105 C 
ENDBRANCH  16  24
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 5