REMARK  Name = BDB060203
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.420   0.447   0.683  0.00  0.00    -0.192 N 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.900  -0.220  -0.492  0.00  0.00    +0.055 A 
ATOM      3  C   LIG    1       -2.968   0.324  -1.225  0.00  0.00    -0.028 A 
ATOM      4  C   LIG    1       -3.640   1.611  -0.833  0.00  0.00    +0.046 C 
ATOM      5  C   LIG    1       -3.395  -0.338  -2.387  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1       -2.795  -1.531  -2.794  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -1.753  -2.076  -2.049  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -1.306  -1.423  -0.900  0.00  0.00    +0.025 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      9  S   LIG    1       -0.175   1.606   0.520  0.00  0.00    +0.076 S 
ATOM     10  O   LIG    1       -0.512   2.516  -0.555  0.00  0.00    -0.150 OA
ATOM     11  O   LIG    1        0.091   2.159   1.833  0.00  0.00    -0.150 OA
BRANCH   9  17
ATOM     12  C   LIG    1        4.705  -1.722  -1.215  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1        3.513  -0.918  -0.790  0.00  0.00    -0.050 A 
ATOM     14  C   LIG    1        2.668  -0.347  -1.739  0.00  0.00    +0.008 A 
ATOM     15  C   LIG    1        1.558   0.440  -1.368  0.00  0.00    -0.023 A 
ATOM     16  C   LIG    1        0.791   1.068  -2.504  0.00  0.00    +0.046 C 
ATOM     17  C   LIG    1        1.284   0.643   0.013  0.00  0.00    +0.115 A 
ATOM     18  C   LIG    1        2.188   0.134   0.984  0.00  0.00    -0.023 A 
ATOM     19  C   LIG    1        2.135   0.433   2.460  0.00  0.00    +0.046 C 
ATOM     20  C   LIG    1        3.282  -0.648   0.558  0.00  0.00    +0.008 A 
ENDBRANCH   9  17
ENDBRANCH   1   9
BRANCH   1  21
ATOM     21  C   LIG    1       -1.508  -0.309   1.948  0.00  0.00    +0.251 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -1.911   0.573   3.108  0.00  0.00    +0.324 C 
ATOM     23  O   LIG    1       -2.747   1.464   3.104  0.00  0.00    -0.249 OA
BRANCH  22  24
ATOM     24  O   LIG    1       -1.281   0.244   4.257  0.00  0.00    -0.479 OA
ATOM     25  H   LIG    1       -1.601   0.926   4.887  0.00  0.00    +0.295 HD
ENDBRANCH  22  24
ENDBRANCH  21  22
ENDBRANCH   1  21
TORSDOF 6