REMARK  Name = BDB050708
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.172  -1.720   2.693  0.00  0.00    -0.132 OA
ATOM      2  S   LIG    1        0.578  -1.574   1.308  0.00  0.00    +0.144 S 
ATOM      3  O   LIG    1        0.611  -2.719   0.419  0.00  0.00    -0.132 OA
ENDROOT
BRANCH   2   4
ATOM      4  C   LIG    1        2.120  -0.779   1.285  0.00  0.00    +0.178 C 
ATOM      5  C   LIG    1        2.801  -0.681   0.133  0.00  0.00    +0.030 C 
BRANCH   5   6
ATOM      6  C   LIG    1        4.101  -0.008   0.011  0.00  0.00    -0.024 A 
ATOM      7  C   LIG    1        4.394   0.681  -1.174  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1        5.627   1.316  -1.342  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        6.584   1.258  -0.332  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1        6.312   0.561   0.843  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        5.079  -0.073   1.012  0.00  0.00    +0.008 A 
ENDBRANCH   5   6
ENDBRANCH   2   4
BRANCH   2  12
ATOM     12  O   LIG    1       -0.314  -0.395   0.622  0.00  0.00    -0.343 OA
BRANCH  12  13
ATOM     13  C   LIG    1       -1.662  -0.515   0.398  0.00  0.00    +0.157 A 
ATOM     14  C   LIG    1       -2.260   0.595  -0.209  0.00  0.00    +0.057 A 
ATOM     15  C   LIG    1       -3.635   0.612  -0.499  0.00  0.00    -0.014 A 
ATOM     16  C   LIG    1       -4.422  -0.513  -0.169  0.00  0.00    -0.018 A 
ATOM     17  C   LIG    1       -5.796  -0.499  -0.458  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1       -6.386   0.612  -1.063  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -5.611   1.721  -1.388  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -3.812  -1.620   0.440  0.00  0.00    +0.012 A 
ATOM     21  C   LIG    1       -4.243   1.722  -1.108  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1       -2.442  -1.622   0.722  0.00  0.00    +0.049 A 
ENDBRANCH  12  13
ENDBRANCH   2  12
TORSDOF 4