REMARK  Name = BDB050710
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1       -0.016   0.073  -1.934  0.00  0.00    +0.144 S 
ATOM      2  O   LIG    1       -0.182  -1.312  -2.332  0.00  0.00    -0.132 OA
ATOM      3  O   LIG    1       -0.218   1.149  -2.886  0.00  0.00    -0.132 OA
ENDROOT
BRANCH   1   4
ATOM      4  C   LIG    1        1.551   0.283  -1.218  0.00  0.00    +0.178 C 
ATOM      5  C   LIG    1        2.056  -0.678  -0.428  0.00  0.00    +0.030 C 
BRANCH   5   6
ATOM      6  C   LIG    1        3.361  -0.581   0.239  0.00  0.00    -0.024 A 
ATOM      7  C   LIG    1        3.513  -1.155   1.508  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1        4.743  -1.105   2.169  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        5.837  -0.492   1.562  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1        5.703   0.068   0.294  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        4.472   0.019  -0.368  0.00  0.00    +0.008 A 
ENDBRANCH   5   6
ENDBRANCH   1   4
BRANCH   1  12
ATOM     12  O   LIG    1       -0.928   0.360  -0.614  0.00  0.00    -0.343 OA
BRANCH  12  16
ATOM     13  C   LIG    1       -4.957   0.881   2.038  0.00  0.00    +0.044 C 
ATOM     14  C   LIG    1       -4.308   0.565   0.724  0.00  0.00    -0.047 A 
ATOM     15  C   LIG    1       -2.913   0.582   0.597  0.00  0.00    +0.052 A 
ATOM     16  C   LIG    1       -2.299   0.319  -0.633  0.00  0.00    +0.157 A 
ATOM     17  C   LIG    1       -3.087   0.049  -1.750  0.00  0.00    +0.048 A 
ATOM     18  C   LIG    1       -4.479   0.045  -1.636  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1       -5.087   0.307  -0.408  0.00  0.00    +0.003 A 
ENDBRANCH  12  16
ENDBRANCH   1  12
TORSDOF 4