REMARK  Name = BDB055763
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.304  -0.468  -1.619  0.00  0.00    +0.067 A 
ATOM      2  C   LIG    1        0.706   0.137  -0.492  0.00  0.00    +0.005 A 
ATOM      3  C   LIG    1        1.553   0.624   0.553  0.00  0.00    -0.009 A 
ATOM      4  C   LIG    1        2.961   0.484   0.425  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        3.810   0.951   1.442  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        3.296   1.554   2.588  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        1.924   1.703   2.731  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        3.509  -0.118  -0.716  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1        1.066   1.246   1.728  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        2.690  -0.591  -1.736  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   2  11
ATOM     11  C   LIG    1       -0.776   0.225  -0.391  0.00  0.00    +0.005 A 
ATOM     12  C   LIG    1       -1.500  -0.792   0.320  0.00  0.00    -0.009 A 
ATOM     13  C   LIG    1       -2.916  -0.725   0.378  0.00  0.00    -0.017 A 
ATOM     14  C   LIG    1       -3.647  -1.710   1.061  0.00  0.00    +0.008 A 
ATOM     15  C   LIG    1       -3.006  -2.770   1.698  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -1.623  -2.856   1.662  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1       -3.591   0.326  -0.248  0.00  0.00    +0.009 A 
ATOM     18  C   LIG    1       -2.892   1.317  -0.933  0.00  0.00    +0.016 A 
ATOM     19  C   LIG    1       -0.883  -1.883   0.984  0.00  0.00    +0.009 A 
ATOM     20  C   LIG    1       -1.493   1.280  -1.014  0.00  0.00    +0.067 A 
BRANCH  20  21
ATOM     21  C   LIG    1       -0.793   2.372  -1.756  0.00  0.00    +0.337 C 
ATOM     22  O   LIG    1        0.377   2.695  -1.674  0.00  0.00    -0.245 OA
BRANCH  21  23
ATOM     23  O   LIG    1       -1.619   3.034  -2.591  0.00  0.00    -0.477 OA
ATOM     24  H   LIG    1       -1.018   3.650  -3.060  0.00  0.00    +0.295 HD
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH   2  11
BRANCH   1  26
ATOM     25  O   LIG    1       -0.123  -0.317  -3.521  0.00  0.00    -0.245 OA
ATOM     26  C   LIG    1        0.484  -1.005  -2.723  0.00  0.00    +0.337 C 
BRANCH  26  27
ATOM     27  O   LIG    1        0.507  -2.355  -2.737  0.00  0.00    -0.477 OA
ATOM     28  H   LIG    1        0.971  -2.754  -1.976  0.00  0.00    +0.295 HD
ENDBRANCH  26  27
ENDBRANCH   1  26
TORSDOF 5