REMARK  Name = BDB009129
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.028  -0.857   0.365  0.00  0.00    +0.065 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.334  -1.530   0.258  0.00  0.00    +0.066 A 
ATOM      3  C   LIG    1       -2.578  -0.708   0.373  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -2.513   0.760   0.695  0.00  0.00    +0.037 C 
ATOM      5  C   LIG    1       -3.873   1.368   1.054  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1       -4.970   0.860   0.127  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1       -5.081  -0.664   0.199  0.00  0.00    +0.041 C 
ATOM      8  C   LIG    1       -3.743  -1.350   0.175  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1       -3.753  -2.812  -0.083  0.00  0.00    +0.268 A 
ATOM     10  O   LIG    1       -4.799  -3.431  -0.253  0.00  0.00    -0.266 OA
ATOM     11  N   LIG    1       -2.530  -3.424  -0.108  0.00  0.00    -0.243 N 
ATOM     12  H   LIG    1       -2.514  -4.423  -0.285  0.00  0.00    +0.192 HD
ATOM     13  N   LIG    1       -1.326  -2.810   0.037  0.00  0.00    -0.176 NA
ENDBRANCH   1   2
BRANCH   1  14
ATOM     14  C   LIG    1        0.477  -0.272  -0.986  0.00  0.00    +0.022 C 
ATOM     15  C   LIG    1        0.957  -1.359  -1.955  0.00  0.00    +0.013 C 
BRANCH  14  18
ATOM     16  C   LIG    1        3.773   1.446   0.004  0.00  0.00    +0.059 A 
ATOM     17  C   LIG    1        2.788   0.464  -0.179  0.00  0.00    +0.019 A 
ATOM     18  C   LIG    1        1.559   0.780  -0.785  0.00  0.00    -0.043 A 
ATOM     19  C   LIG    1        1.335   2.099  -1.207  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1        2.311   3.080  -1.028  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        3.525   2.756  -0.424  0.00  0.00    +0.015 A 
BRANCH  16  22
ATOM     22  C   LIG    1        5.086   1.154   0.642  0.00  0.00    +0.339 C 
ATOM     23  O   LIG    1        5.955   1.995   0.812  0.00  0.00    -0.245 OA
BRANCH  22  25
ATOM     24  C   LIG    1        6.403  -0.509   1.618  0.00  0.00    +0.280 C 
ATOM     25  O   LIG    1        5.166  -0.152   0.999  0.00  0.00    -0.464 OA
ENDBRANCH  22  25
ENDBRANCH  16  22
ENDBRANCH  14  18
ENDBRANCH   1  14
TORSDOF 5