REMARK  Name = BDB026416
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.321   0.745   0.410  0.00  0.00    -0.279 N 
ATOM      2  C   LIG    1       -1.245   0.683   1.297  0.00  0.00    +0.306 C 
ATOM      3  O   LIG    1       -0.803   1.604   1.963  0.00  0.00    -0.252 OA
ATOM      4  N   LIG    1       -0.737  -0.617   1.253  0.00  0.00    -0.276 N 
ATOM      5  C   LIG    1       -1.566  -1.477   0.421  0.00  0.00    +0.055 C 
ATOM      6  C   LIG    1       -2.527  -2.354   1.240  0.00  0.00    +0.027 C 
ATOM      7  C   LIG    1       -2.935  -3.486   0.293  0.00  0.00    +0.002 C 
ATOM      8  C   LIG    1       -1.929  -3.472  -0.859  0.00  0.00    +0.002 C 
ATOM      9  C   LIG    1       -0.830  -2.506  -0.433  0.00  0.00    +0.027 C 
ATOM     10  C   LIG    1       -2.345  -0.445  -0.421  0.00  0.00    +0.135 C 
ENDROOT
BRANCH   1  11
ATOM     11  C   LIG    1       -2.851   2.018  -0.037  0.00  0.00    +0.146 C 
BRANCH  11  16
ATOM     12  C   LIG    1       -8.324   1.712  -1.790  0.00  0.00    +0.065 C 
ATOM     13  C   LIG    1       -6.909   1.785  -1.301  0.00  0.00    +0.038 A 
ATOM     14  N   LIG    1       -5.952   2.081  -2.211  0.00  0.00    -0.260 NA
ATOM     15  C   LIG    1       -4.675   2.154  -1.770  0.00  0.00    +0.116 A 
ATOM     16  C   LIG    1       -4.290   1.935  -0.453  0.00  0.00    -0.012 A 
ATOM     17  C   LIG    1       -5.297   1.631   0.465  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1       -6.621   1.555   0.040  0.00  0.00    +0.023 A 
ENDBRANCH  11  16
ENDBRANCH   1  11
BRANCH   4  19
ATOM     19  C   LIG    1        0.369  -1.067   2.086  0.00  0.00    +0.142 C 
BRANCH  19  20
ATOM     20  C   LIG    1        1.747  -0.948   1.409  0.00  0.00    +0.146 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.678  -1.742   2.156  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        3.552  -1.564   1.767  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        2.232   0.518   1.308  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.586   0.711   0.778  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        3.890   0.099  -0.507  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        5.225   0.558  -1.044  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        6.304   0.667  -0.149  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        7.570   1.026  -0.618  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        7.759   1.292  -1.974  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.690   1.189  -2.865  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        6.051   0.331   1.296  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        5.427   0.816  -2.404  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        4.660   0.802   1.765  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   4  19
TORSDOF 7