REMARK  Name = BDB057388
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.547  -0.771  -0.240  0.00  0.00    +0.124 A 
ATOM      2  C   LIG    1       -2.415  -1.849  -0.038  0.00  0.00    +0.091 A 
ATOM      3  C   LIG    1       -3.733  -1.583   0.271  0.00  0.00    +0.128 A 
ATOM      4  O   LIG    1       -4.682  -2.549   0.496  0.00  0.00    -0.491 OA
ATOM      5  C   LIG    1       -5.929  -1.812   0.441  0.00  0.00    +0.238 C 
ATOM      6  C   LIG    1       -5.636  -0.355   0.825  0.00  0.00    +0.071 C 
ATOM      7  C   LIG    1       -4.210  -0.287   0.408  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -3.366   0.793   0.230  0.00  0.00    +0.011 A 
ATOM      9  C   LIG    1       -2.026   0.544  -0.102  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1  10
ATOM     10  O   LIG    1       -0.264  -1.134  -0.544  0.00  0.00    -0.492 OA
BRANCH  10  11
ATOM     11  C   LIG    1        0.674  -0.125  -0.917  0.00  0.00    +0.232 C 
BRANCH  11  12
ATOM     12  C   LIG    1        1.401   0.436   0.306  0.00  0.00    +0.082 C 
BRANCH  12  13
ATOM     13  C   LIG    1        2.231  -0.627   1.027  0.00  0.00    +0.232 C 
BRANCH  13  14
ATOM     14  O   LIG    1        3.262  -1.146   0.187  0.00  0.00    -0.492 OA
BRANCH  14  19
ATOM     15  C   LIG    1        8.386   1.229  -0.388  0.00  0.00    +0.044 C 
ATOM     16  C   LIG    1        7.013   0.644  -0.234  0.00  0.00    -0.050 A 
ATOM     17  C   LIG    1        6.675  -0.549  -0.878  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1        5.405  -1.106  -0.705  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        4.459  -0.491   0.118  0.00  0.00    +0.121 A 
ATOM     20  C   LIG    1        4.798   0.692   0.771  0.00  0.00    +0.046 A 
ATOM     21  C   LIG    1        6.070   1.253   0.601  0.00  0.00    +0.007 A 
ENDBRANCH  14  19
ENDBRANCH  13  14
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   1  10
BRANCH   6  22
ATOM     22  C   LIG    1       -6.605   0.691   0.285  0.00  0.00    +0.132 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -6.684   0.814  -1.220  0.00  0.00    +0.305 C 
ATOM     24  O   LIG    1       -6.235   0.022  -2.030  0.00  0.00    -0.251 OA
BRANCH  23  25
ATOM     25  O   LIG    1       -7.367   1.919  -1.605  0.00  0.00    -0.481 OA
ATOM     26  H   LIG    1       -7.698   2.468  -0.870  0.00  0.00    +0.295 HD
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 9