REMARK  Name = BDB024070
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.653  -0.279   0.958  0.00  0.00    +0.052 C 
ATOM      2  C   LIG    1       -0.596  -0.396   1.433  0.00  0.00    +0.012 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1       -1.782  -0.484   0.574  0.00  0.00    -0.024 A 
ATOM      4  C   LIG    1       -1.970   0.364  -0.523  0.00  0.00    +0.015 A 
ATOM      5  C   LIG    1       -3.129   0.283  -1.314  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -3.258   1.182  -2.509  0.00  0.00    +0.047 C 
ATOM      7  C   LIG    1       -4.135  -0.629  -0.955  0.00  0.00    +0.128 A 
ATOM      8  C   LIG    1       -3.936  -1.532   0.102  0.00  0.00    -0.008 A 
ATOM      9  C   LIG    1       -4.945  -2.586   0.456  0.00  0.00    +0.047 C 
ATOM     10  C   LIG    1       -2.771  -1.424   0.880  0.00  0.00    +0.015 A 
BRANCH   7  11
ATOM     11  O   LIG    1       -5.283  -0.713  -1.695  0.00  0.00    -0.475 OA
BRANCH  11  12
ATOM     12  C   LIG    1       -6.385   0.153  -1.329  0.00  0.00    +0.200 C 
ATOM     13  C   LIG    1       -7.607  -0.766  -1.167  0.00  0.00    +0.067 C 
ATOM     14  C   LIG    1       -6.210   0.996  -0.052  0.00  0.00    +0.067 C 
BRANCH  12  15
ATOM     15  C   LIG    1       -6.692   1.071  -2.528  0.00  0.00    +0.348 C 
ATOM     16  O   LIG    1       -6.220   1.013  -3.653  0.00  0.00    -0.247 OA
BRANCH  15  17
ATOM     17  O   LIG    1       -7.628   2.013  -2.266  0.00  0.00    -0.478 OA
ATOM     18  H   LIG    1       -7.721   2.486  -3.120  0.00  0.00    +0.295 HD
ENDBRANCH  15  17
ENDBRANCH  12  15
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   2   3
BRANCH   1  19
ATOM     19  C   LIG    1        1.796  -0.202   1.907  0.00  0.00    +0.191 C 
ATOM     20  O   LIG    1        1.630  -0.072   3.117  0.00  0.00    -0.287 OA
BRANCH  19  27
ATOM     21  C   LIG    1        7.685   1.588   1.504  0.00  0.00    +0.121 A 
ATOM     22  C   LIG    1        6.381   1.567   2.000  0.00  0.00    +0.055 A 
ATOM     23  C   LIG    1        5.414   0.705   1.454  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1        5.752  -0.154   0.390  0.00  0.00    +0.075 A 
ATOM     25  N   LIG    1        4.866  -1.003  -0.160  0.00  0.00    -0.212 NA
ATOM     26  C   LIG    1        3.602  -1.028   0.333  0.00  0.00    +0.226 A 
ATOM     27  C   LIG    1        3.168  -0.198   1.359  0.00  0.00    +0.084 A 
ATOM     28  C   LIG    1        7.053  -0.116  -0.091  0.00  0.00    +0.032 A 
ATOM     29  C   LIG    1        4.100   0.667   1.936  0.00  0.00    +0.027 A 
ATOM     30  C   LIG    1        8.019   0.741   0.452  0.00  0.00    +0.048 A 
BRANCH  21  32
ATOM     31  C   LIG    1        9.874   2.497   1.685  0.00  0.00    +0.277 C 
ATOM     32  O   LIG    1        8.521   2.472   2.124  0.00  0.00    -0.495 OA
ENDBRANCH  21  32
BRANCH  26  33
ATOM     33  O   LIG    1        2.719  -1.951  -0.189  0.00  0.00    -0.479 OA
ATOM     34  C   LIG    1        3.287  -2.795  -1.186  0.00  0.00    +0.279 C 
ENDBRANCH  26  33
ENDBRANCH  19  27
ENDBRANCH   1  19
TORSDOF 9