REMARK  Name = BDB057387
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.684  -0.357  -1.629  0.00  0.00    +0.232 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        1.884  -0.367  -2.407  0.00  0.00    -0.492 OA
BRANCH   2   7
ATOM      3  C   LIG    1        6.907  -0.785   0.076  0.00  0.00    +0.071 C 
ATOM      4  C   LIG    1        5.672  -0.653  -0.746  0.00  0.00    +0.001 A 
ATOM      5  C   LIG    1        4.582  -0.482   0.093  0.00  0.00    +0.128 A 
ATOM      6  C   LIG    1        3.286  -0.389  -0.380  0.00  0.00    +0.091 A 
ATOM      7  C   LIG    1        3.085  -0.460  -1.759  0.00  0.00    +0.124 A 
ATOM      8  C   LIG    1        4.190  -0.628  -2.615  0.00  0.00    +0.046 A 
ATOM      9  O   LIG    1        4.911  -0.427   1.423  0.00  0.00    -0.491 OA
ATOM     10  C   LIG    1        5.492  -0.737  -2.114  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        6.350  -0.263   1.413  0.00  0.00    +0.238 C 
BRANCH   3  12
ATOM     12  C   LIG    1        8.103   0.007  -0.440  0.00  0.00    +0.132 C 
BRANCH  12  14
ATOM     13  O   LIG    1        9.360  -0.723   1.522  0.00  0.00    -0.251 OA
ATOM     14  C   LIG    1        9.309  -0.171   0.437  0.00  0.00    +0.305 C 
BRANCH  14  15
ATOM     15  O   LIG    1       10.409   0.391  -0.101  0.00  0.00    -0.481 OA
ATOM     16  H   LIG    1       11.118   0.222   0.554  0.00  0.00    +0.295 HD
ENDBRANCH  14  15
ENDBRANCH  12  14
ENDBRANCH   3  12
ENDBRANCH   2   7
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1        0.306   1.073  -1.246  0.00  0.00    +0.082 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.944   1.119  -0.375  0.00  0.00    +0.232 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -2.040   0.585  -1.114  0.00  0.00    -0.492 OA
BRANCH  19  20
ATOM     20  C   LIG    1       -3.257   0.554  -0.492  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1       -3.527   0.976   0.808  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1       -4.828   0.887   1.321  0.00  0.00    +0.012 A 
ATOM     23  C   LIG    1       -5.885   0.377   0.549  0.00  0.00    -0.018 A 
ATOM     24  C   LIG    1       -5.595  -0.044  -0.757  0.00  0.00    +0.012 A 
ATOM     25  C   LIG    1       -4.297   0.043  -1.270  0.00  0.00    +0.046 A 
BRANCH  23  26
ATOM     26  C   LIG    1       -7.250   0.289   1.093  0.00  0.00    -0.018 A 
ATOM     27  C   LIG    1       -7.504  -0.357   2.314  0.00  0.00    +0.008 A 
ATOM     28  C   LIG    1       -8.800  -0.438   2.832  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -9.865   0.128   2.136  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -9.636   0.772   0.923  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1       -8.340   0.851   0.406  0.00  0.00    +0.008 A 
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 10