REMARK  Name = BDB062873
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.815   1.720  -0.309  0.00  0.00    +0.045 A 
ATOM      2  C   LIG    1        2.041   1.157  -0.634  0.00  0.00    +0.006 A 
ATOM      3  C   LIG    1        2.763  -0.021  -0.175  0.00  0.00    -0.005 A 
ATOM      4  C   LIG    1        3.978  -0.120  -0.880  0.00  0.00    +0.033 A 
ATOM      5  C   LIG    1        4.048   1.013  -1.820  0.00  0.00    +0.194 C 
ATOM      6  O   LIG    1        4.945   1.254  -2.599  0.00  0.00    -0.287 OA
ATOM      7  C   LIG    1        4.905  -1.129  -0.695  0.00  0.00    +0.057 A 
ATOM      8  C   LIG    1        4.585  -2.090   0.254  0.00  0.00    +0.118 A 
ATOM      9  C   LIG    1        3.385  -2.031   0.977  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1        2.464  -0.993   0.765  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        2.805   1.789  -1.634  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1        2.413   2.932  -2.310  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1        1.182   3.485  -1.968  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        0.387   2.887  -0.976  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  16
ATOM     15  O   LIG    1        0.299   1.127   1.902  0.00  0.00    -0.270 OA
ATOM     16  C   LIG    1       -0.061   1.159   0.734  0.00  0.00    +0.246 C 
ATOM     17  N   LIG    1       -1.284   0.719   0.287  0.00  0.00    -0.295 N 
ATOM     18  H   LIG    1       -1.558   0.942  -0.662  0.00  0.00    +0.150 HD
BRANCH  17  19
ATOM     19  CA  LIG    1       -2.362   0.477   1.233  0.00  0.00    +0.213 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -3.206  -0.694   0.767  0.00  0.00    -0.016 A 
ATOM     21  C   LIG    1       -4.210  -0.545  -0.204  0.00  0.00    +0.006 A 
ATOM     22  C   LIG    1       -4.960  -1.646  -0.622  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -4.710  -2.908  -0.087  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -3.703  -3.073   0.862  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -2.952  -1.975   1.283  0.00  0.00    +0.006 A 
ENDBRANCH  19  20
BRANCH  19  26
ATOM     26  C   LIG    1       -3.185   1.771   1.418  0.00  0.00    +0.330 C 
ATOM     27  O   LIG    1       -3.071   2.770   0.715  0.00  0.00    -0.249 OA
BRANCH  26  28
ATOM     28  OXT LIG    1       -4.099   1.705   2.419  0.00  0.00    -0.479 OA
ATOM     29  HXT LIG    1       -4.124   0.840   2.875  0.00  0.00    +0.295 HD
ENDBRANCH  26  28
ENDBRANCH  19  26
ENDBRANCH  17  19
ENDBRANCH   1  16
BRANCH   8  30
ATOM     30  O   LIG    1        5.426  -3.131   0.517  0.00  0.00    -0.507 OA
ATOM     31  H   LIG    1        6.222  -3.040  -0.034  0.00  0.00    +0.292 HD
ENDBRANCH   8  30
TORSDOF 6