REMARK  Name = BDB059207
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.983   0.494   1.617  0.00  0.00    +0.191 A 
ATOM      2  N   LIG    1       -1.430   1.471   0.822  0.00  0.00    -0.220 NA
ATOM      3  C   LIG    1       -0.632   1.853  -0.202  0.00  0.00    +0.100 A 
ATOM      4  C   LIG    1        0.587   1.264  -0.470  0.00  0.00    +0.110 A 
ATOM      5  C   LIG    1        0.954   0.261   0.408  0.00  0.00    +0.127 A 
ATOM      6  N   LIG    1        0.195  -0.119   1.462  0.00  0.00    -0.214 NA
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -1.223   2.934  -0.995  0.00  0.00    +0.039 A 
ATOM      8  S   LIG    1       -0.439   4.457  -1.107  0.00  0.00    -0.095 S 
ATOM      9  C   LIG    1       -1.677   5.096  -2.098  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1       -2.687   4.186  -2.316  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1       -2.431   2.942  -1.667  0.00  0.00    +0.018 A 
ENDBRANCH   3   7
BRANCH   4  12
ATOM     12  C   LIG    1        1.399   1.637  -1.581  0.00  0.00    +0.104 C 
ATOM     13  N   LIG    1        2.090   1.921  -2.469  0.00  0.00    -0.191 NA
ENDBRANCH   4  12
BRANCH   1  14
ATOM     14  S   LIG    1       -2.024   0.030   2.969  0.00  0.00    -0.073 S 
BRANCH  14  15
ATOM     15  C   LIG    1       -1.416  -1.659   3.248  0.00  0.00    +0.165 C 
BRANCH  15  17
ATOM     16  C   LIG    1       -2.861  -2.910   5.114  0.00  0.00    +0.004 C 
ATOM     17  C   LIG    1       -2.212  -2.345   4.276  0.00  0.00    -0.094 C 
ENDBRANCH  15  17
ENDBRANCH  14  15
ENDBRANCH   1  14
BRANCH   5  18
ATOM     18  S   LIG    1        2.490  -0.648   0.260  0.00  0.00    -0.027 S 
BRANCH  18  19
ATOM     19  C   LIG    1        1.965  -1.831  -0.883  0.00  0.00    +0.215 A 
ATOM     20  N   LIG    1        2.749  -2.854  -1.331  0.00  0.00    -0.223 N 
ATOM     21  C   LIG    1        4.106  -3.189  -1.000  0.00  0.00    +0.177 C 
ATOM     22  N   LIG    1        2.054  -3.597  -2.209  0.00  0.00    -0.043 NA
ATOM     23  N   LIG    1        0.865  -3.016  -2.293  0.00  0.00    -0.022 NA
ATOM     24  N   LIG    1        0.795  -1.913  -1.475  0.00  0.00    -0.101 NA
ENDBRANCH  18  19
ENDBRANCH   5  18
TORSDOF 7