REMARK  Name = BDB001404
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.659  -0.902   0.713  0.00  0.00    +0.206 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1       -4.026  -3.582   0.092  0.00  0.00    +0.000 A 
ATOM      3  C   LIG    1       -3.315  -3.076  -0.993  0.00  0.00    +0.000 A 
ATOM      4  C   LIG    1       -2.233  -2.220  -0.781  0.00  0.00    +0.006 A 
ATOM      5  C   LIG    1       -1.843  -1.861   0.522  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -2.575  -2.376   1.605  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1       -3.657  -3.233   1.389  0.00  0.00    +0.000 A 
ENDBRANCH   1   5
BRANCH   1   8
ATOM      8  C   LIG    1       -1.057   0.529   0.342  0.00  0.00    +0.072 A 
ATOM      9  N   LIG    1       -0.536   1.046  -0.804  0.00  0.00    -0.257 NA
ATOM     10  C   LIG    1       -0.869   2.314  -1.127  0.00  0.00    +0.111 A 
ATOM     11  C   LIG    1       -1.705   3.109  -0.364  0.00  0.00    +0.020 A 
ATOM     12  C   LIG    1       -2.236   2.572   0.802  0.00  0.00    +0.003 A 
ATOM     13  C   LIG    1       -1.911   1.268   1.163  0.00  0.00    +0.026 A 
ENDBRANCH   1   8
BRANCH   1  14
ATOM     14  N   LIG    1       -0.098  -0.992   2.092  0.00  0.00    -0.171 NA
ATOM     15  N   LIG    1        1.027  -0.519   2.393  0.00  0.00    -0.126 NA
BRANCH  15  16
ATOM     16  C   LIG    1        1.889  -0.017   1.467  0.00  0.00    +0.214 A 
ATOM     17  S   LIG    1        2.417   1.619   1.649  0.00  0.00    -0.046 S 
ATOM     18  C   LIG    1        3.362   1.487   0.221  0.00  0.00    +0.041 A 
ATOM     19  C   LIG    1        3.241   0.192  -0.283  0.00  0.00    +0.081 A 
ATOM     20  C   LIG    1        3.942  -0.146  -1.458  0.00  0.00    +0.029 A 
ATOM     21  C   LIG    1        4.738   0.812  -2.094  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        4.844   2.098  -1.573  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        4.159   2.457  -0.408  0.00  0.00    +0.017 A 
ATOM     24  N   LIG    1        2.426  -0.655   0.446  0.00  0.00    -0.220 NA
ENDBRANCH  15  16
ENDBRANCH   1  14
TORSDOF 4