REMARK  Name = BDB001960
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.070  -0.415   2.082  0.00  0.00    -0.456 OA
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1       -3.421   0.210  -0.079  0.00  0.00    +0.093 A 
ATOM      3  C   LIG    1       -2.297   0.988  -0.378  0.00  0.00    +0.031 A 
ATOM      4  C   LIG    1       -1.115   0.789   0.337  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1       -1.058  -0.199   1.325  0.00  0.00    +0.129 A 
ATOM      6  C   LIG    1       -2.184  -0.968   1.626  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1       -3.369  -0.775   0.913  0.00  0.00    +0.031 A 
BRANCH   2   8
ATOM      8  S   LIG    1       -4.927   0.442  -1.006  0.00  0.00    +0.018 S 
ATOM      9  O   LIG    1       -5.621  -0.833  -1.014  0.00  0.00    -0.165 OA
ATOM     10  O   LIG    1       -4.559   1.086  -2.253  0.00  0.00    -0.165 OA
BRANCH   8  12
ATOM     11  C   LIG    1       -6.670   1.195   0.893  0.00  0.00    +0.029 C 
ATOM     12  C   LIG    1       -5.777   1.595  -0.022  0.00  0.00    +0.132 C 
ENDBRANCH   8  12
ENDBRANCH   2   8
ENDBRANCH   1   5
BRANCH   1  13
ATOM     13  C   LIG    1        1.255  -0.598   1.405  0.00  0.00    +0.129 A 
ATOM     14  C   LIG    1        1.376  -1.463   0.312  0.00  0.00    +0.048 A 
ATOM     15  C   LIG    1        2.615  -1.633  -0.307  0.00  0.00    +0.031 A 
ATOM     16  C   LIG    1        3.728  -0.937   0.178  0.00  0.00    +0.093 A 
ATOM     17  C   LIG    1        3.619  -0.100   1.294  0.00  0.00    +0.031 A 
ATOM     18  C   LIG    1        2.377   0.065   1.908  0.00  0.00    +0.048 A 
BRANCH  16  19
ATOM     19  S   LIG    1        5.317  -1.172  -0.597  0.00  0.00    +0.018 S 
ATOM     20  O   LIG    1        5.303  -2.496  -1.190  0.00  0.00    -0.165 OA
ATOM     21  O   LIG    1        6.329  -0.814   0.381  0.00  0.00    -0.165 OA
BRANCH  19  22
ATOM     22  C   LIG    1        5.270   0.005  -1.875  0.00  0.00    +0.132 C 
ATOM     23  C   LIG    1        5.697   1.258  -1.672  0.00  0.00    +0.029 C 
ENDBRANCH  19  22
ENDBRANCH  16  19
ENDBRANCH   1  13
TORSDOF 6