REMARK  Name = BDB001669
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.420  -0.437   0.509  0.00  0.00    -0.109 OA
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        1.765  -0.281   0.190  0.00  0.00    -0.079 N 
ATOM      3  C   LIG    1        2.248   0.921  -0.217  0.00  0.00    +0.279 C 
ATOM      4  O   LIG    1        1.667   1.956  -0.478  0.00  0.00    -0.267 OA
ATOM      5  C   LIG    1        3.704   0.774  -0.191  0.00  0.00    +0.052 A 
ATOM      6  C   LIG    1        3.990  -0.465   0.366  0.00  0.00    +0.052 A 
ATOM      7  C   LIG    1        5.286  -0.896   0.565  0.00  0.00    +0.014 A 
ATOM      8  C   LIG    1        6.312  -0.032   0.169  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        6.022   1.228  -0.398  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        4.700   1.648  -0.579  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1        2.715  -1.107   0.694  0.00  0.00    +0.279 C 
ATOM     12  O   LIG    1        2.612  -2.125   1.350  0.00  0.00    -0.267 OA
ENDBRANCH   1   2
BRANCH   1  13
ATOM     13  S   LIG    1       -0.407  -1.199  -0.680  0.00  0.00    +0.132 S 
ATOM     14  O   LIG    1       -0.073  -0.600  -1.958  0.00  0.00    -0.140 OA
ATOM     15  O   LIG    1       -0.239  -2.627  -0.487  0.00  0.00    -0.140 OA
BRANCH  13  21
ATOM     16  C   LIG    1       -6.257  -0.042   0.566  0.00  0.00    +0.044 C 
ATOM     17  C   LIG    1       -4.820  -0.312   0.224  0.00  0.00    -0.050 A 
ATOM     18  C   LIG    1       -3.919   0.750   0.065  0.00  0.00    +0.008 A 
ATOM     19  C   LIG    1       -2.562   0.527  -0.230  0.00  0.00    -0.023 A 
ATOM     20  C   LIG    1       -1.659   1.719  -0.390  0.00  0.00    +0.046 C 
ATOM     21  C   LIG    1       -2.117  -0.804  -0.338  0.00  0.00    +0.122 A 
ATOM     22  C   LIG    1       -3.011  -1.872  -0.168  0.00  0.00    +0.030 A 
ATOM     23  C   LIG    1       -4.354  -1.624   0.117  0.00  0.00    +0.005 A 
ENDBRANCH  13  21
ENDBRANCH   1  13
TORSDOF 3