REMARK  Name = BDB003064
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.634  -0.192   0.534  0.00  0.00    +0.056 A 
ATOM      2  C   LIG    1        0.516  -1.441   1.158  0.00  0.00    +0.053 A 
ATOM      3 CL   LIG    1       -0.964  -2.323   1.288  0.00  0.00    -0.083 Cl
ATOM      4  C   LIG    1        1.651  -2.057   1.700  0.00  0.00    +0.022 A 
ATOM      5  C   LIG    1        2.903  -1.444   1.612  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1        3.043  -0.213   0.971  0.00  0.00    +0.008 A 
ATOM      7  C   LIG    1        1.907   0.409   0.448  0.00  0.00    +0.029 A 
ENDROOT
BRANCH   1  10
ATOM      8  N   LIG    1       -1.746   0.423   0.453  0.00  0.00    -0.311 N 
ATOM      9  H   LIG    1       -1.905  -0.296   1.149  0.00  0.00    +0.149 HD
ATOM     10  C   LIG    1       -0.485   0.585  -0.075  0.00  0.00    +0.246 C 
ATOM     11  O   LIG    1       -0.244   1.369  -0.989  0.00  0.00    -0.270 OA
BRANCH   8  12
ATOM     12  C   LIG    1       -2.896   1.128  -0.073  0.00  0.00    +0.104 C 
BRANCH  12  14
ATOM     13  C   LIG    1       -4.061  -0.893  -1.075  0.00  0.00    +0.005 C 
ATOM     14  C   LIG    1       -3.466   0.482  -1.335  0.00  0.00    +0.015 C 
ENDBRANCH  12  14
ENDBRANCH   8  12
ENDBRANCH   1  10
BRANCH   6  15
ATOM     15  S   LIG    1        4.664   0.528   0.898  0.00  0.00    -0.129 S 
ATOM     16  C   LIG    1        4.719   1.066  -0.834  0.00  0.00    +0.090 C 
ENDBRANCH   6  15
TORSDOF 4