REMARK  Name = BDB000520
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.784  -0.104  -2.236  0.00  0.00    -0.492 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.025  -0.179  -1.661  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1       -2.365  -0.950  -0.547  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1       -3.677  -0.916  -0.094  0.00  0.00    -0.040 A 
ATOM      5  C   LIG    1       -4.254  -1.629   1.088  0.00  0.00    +0.036 C 
ATOM      6  C   LIG    1       -5.758  -1.521   0.795  0.00  0.00    +0.013 C 
ATOM      7  C   LIG    1       -5.972  -0.223  -0.018  0.00  0.00    +0.030 C 
ATOM      8  C   LIG    1       -4.642  -0.118  -0.717  0.00  0.00    -0.040 A 
ATOM      9  C   LIG    1       -4.318   0.653  -1.819  0.00  0.00    +0.008 A 
ATOM     10  C   LIG    1       -3.002   0.615  -2.289  0.00  0.00    +0.046 A 
BRANCH   7  11
ATOM     11  C   LIG    1       -6.237   1.003   0.859  0.00  0.00    +0.128 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -7.627   0.984   1.433  0.00  0.00    +0.305 C 
ATOM     13  O   LIG    1       -8.514   0.179   1.207  0.00  0.00    -0.251 OA
BRANCH  12  14
ATOM     14  O   LIG    1       -7.836   2.014   2.276  0.00  0.00    -0.481 OA
ATOM     15  H   LIG    1       -8.763   1.898   2.572  0.00  0.00    +0.295 HD
ENDBRANCH  12  14
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1        0.251  -0.895  -1.650  0.00  0.00    +0.232 C 
BRANCH  16  17
ATOM     17  C   LIG    1        1.539  -0.670  -2.441  0.00  0.00    +0.082 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.070   0.757  -2.295  0.00  0.00    +0.232 C 
BRANCH  18  19
ATOM     19  O   LIG    1        2.387   1.061  -0.937  0.00  0.00    -0.492 OA
BRANCH  19  25
ATOM     20  C   LIG    1        8.354  -0.654   1.331  0.00  0.00    +0.149 C 
ATOM     21  N   LIG    1        7.104  -0.015   1.675  0.00  0.00    -0.350 N 
ATOM     22  C   LIG    1        6.033   0.140   0.819  0.00  0.00    +0.049 A 
ATOM     23  C   LIG    1        5.036   0.804   1.536  0.00  0.00    +0.003 A 
ATOM     24  C   LIG    1        3.817   1.095   0.893  0.00  0.00    +0.055 A 
ATOM     25  C   LIG    1        3.617   0.721  -0.443  0.00  0.00    +0.121 A 
ATOM     26  C   LIG    1        4.629   0.059  -1.133  0.00  0.00    +0.048 A 
ATOM     27  C   LIG    1        5.540   1.040   2.843  0.00  0.00    +0.028 A 
ATOM     28  C   LIG    1        5.853  -0.243  -0.518  0.00  0.00    +0.030 A 
ATOM     29  C   LIG    1        6.815   0.525   2.900  0.00  0.00    +0.086 A 
ENDBRANCH  19  25
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 9