REMARK  Name = BDB051379
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.851  -0.348   0.104  0.00  0.00    -0.492 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.185  -0.201   0.361  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1       -2.614   1.123   0.473  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1       -3.954   1.420   0.731  0.00  0.00    +0.007 A 
ATOM      5  C   LIG    1       -4.889   0.389   0.878  0.00  0.00    -0.047 A 
ATOM      6  C   LIG    1       -4.456  -0.938   0.765  0.00  0.00    +0.007 A 
ATOM      7  C   LIG    1       -3.112  -1.231   0.507  0.00  0.00    +0.046 A 
BRANCH   5   8
ATOM      8  C   LIG    1       -6.346   0.704   1.113  0.00  0.00    +0.046 C 
BRANCH   8   9
ATOM      9  C   LIG    1       -7.061   1.128  -0.164  0.00  0.00    +0.125 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -7.351  -0.052  -1.056  0.00  0.00    +0.305 C 
ATOM     11  O   LIG    1       -8.399  -0.681  -1.026  0.00  0.00    -0.251 OA
BRANCH  10  12
ATOM     12  O   LIG    1       -6.338  -0.371  -1.890  0.00  0.00    -0.481 OA
ATOM     13  H   LIG    1       -5.531   0.164  -1.755  0.00  0.00    +0.295 HD
ENDBRANCH  10  12
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  14
ATOM     14  C   LIG    1       -0.340  -1.680   0.054  0.00  0.00    +0.232 C 
BRANCH  14  15
ATOM     15  C   LIG    1        1.162  -1.614  -0.193  0.00  0.00    +0.082 C 
BRANCH  15  16
ATOM     16  C   LIG    1        1.897  -0.916   0.950  0.00  0.00    +0.232 C 
BRANCH  16  17
ATOM     17  O   LIG    1        3.304  -0.916   0.706  0.00  0.00    -0.492 OA
BRANCH  17  22
ATOM     18  C   LIG    1        7.457   1.259  -0.754  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1        5.956   1.202  -0.669  0.00  0.00    -0.044 A 
ATOM     20  C   LIG    1        5.285   0.171   0.031  0.00  0.00    -0.006 A 
ATOM     21  C   LIG    1        6.064  -0.937   0.698  0.00  0.00    +0.048 C 
ATOM     22  C   LIG    1        3.872   0.149   0.055  0.00  0.00    +0.124 A 
ATOM     23  C   LIG    1        3.152   1.162  -0.584  0.00  0.00    +0.046 A 
ATOM     24  C   LIG    1        3.817   2.193  -1.246  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        5.207   2.213  -1.288  0.00  0.00    +0.004 A 
ENDBRANCH  17  22
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 10