REMARK  Name = BDB057373
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.835  -0.484   0.853  0.00  0.00    +0.071 C 
ATOM      2  C   LIG    1        3.583   0.237   0.492  0.00  0.00    +0.001 A 
ATOM      3  C   LIG    1        2.549  -0.231   1.291  0.00  0.00    +0.128 A 
ATOM      4  C   LIG    1        1.270   0.293   1.242  0.00  0.00    +0.091 A 
ATOM      5  C   LIG    1        1.022   1.325   0.339  0.00  0.00    +0.124 A 
ATOM      6  C   LIG    1        2.064   1.798  -0.482  0.00  0.00    +0.046 A 
ATOM      7  O   LIG    1        2.923  -1.248   2.135  0.00  0.00    -0.491 OA
ATOM      8  C   LIG    1        3.355   1.263  -0.405  0.00  0.00    +0.011 A 
ATOM      9  C   LIG    1        4.199  -1.668   1.598  0.00  0.00    +0.238 C 
ENDROOT
BRANCH   1  10
ATOM     10  C   LIG    1        5.716  -0.947  -0.297  0.00  0.00    +0.132 C 
BRANCH  10  12
ATOM     11  O   LIG    1        6.565   0.786  -1.776  0.00  0.00    -0.251 OA
ATOM     12  C   LIG    1        6.645   0.144  -0.743  0.00  0.00    +0.305 C 
BRANCH  12  13
ATOM     13  O   LIG    1        7.639   0.372   0.136  0.00  0.00    -0.481 OA
ATOM     14  H   LIG    1        8.164   1.092  -0.276  0.00  0.00    +0.295 HD
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   1  10
BRANCH   5  15
ATOM     15  O   LIG    1       -0.176   1.956   0.141  0.00  0.00    -0.492 OA
BRANCH  15  16
ATOM     16  C   LIG    1       -1.268   1.641   1.004  0.00  0.00    +0.232 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.071   0.468   0.454  0.00  0.00    +0.082 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -3.284   0.172   1.327  0.00  0.00    +0.232 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -3.994  -0.965   0.836  0.00  0.00    -0.492 OA
BRANCH  19  20
ATOM     20  C   LIG    1       -4.994  -0.773  -0.075  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1       -5.311   0.423  -0.719  0.00  0.00    +0.045 A 
ATOM     22  C   LIG    1       -6.364   0.469  -1.639  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -7.101  -0.678  -1.923  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.786  -1.877  -1.289  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -5.734  -1.921  -0.371  0.00  0.00    +0.045 A 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   5  15
TORSDOF 9