REMARK  Name = BDB060992
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.255  -0.055  -0.628  0.00  0.00    +0.032 A 
ATOM      2  C   LIG    1       -2.921   0.335  -0.313  0.00  0.00    +0.005 A 
ATOM      3  C   LIG    1       -2.028  -0.613   0.268  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1       -0.705  -0.186   0.588  0.00  0.00    +0.113 A 
ATOM      5  C   LIG    1       -0.288   1.134   0.367  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1       -1.157   2.045  -0.210  0.00  0.00    +0.003 A 
ATOM      7  C   LIG    1       -2.520  -1.923   0.495  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1       -3.808  -2.306   0.129  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -2.447   1.647  -0.551  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1       -4.659  -1.382  -0.453  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1       -5.160   0.785  -1.321  0.00  0.00    -0.357 N 
ATOM     12  H   LIG    1       -5.080   0.631  -2.325  0.00  0.00    +0.142 HD
ATOM     13  H   LIG    1       -5.029   1.768  -1.111  0.00  0.00    +0.142 HD
ENDBRANCH   1  11
BRANCH   4  14
ATOM     14  S   LIG    1        0.482  -1.331   1.266  0.00  0.00    +0.059 S 
ATOM     15  O   LIG    1        0.258  -1.379   2.693  0.00  0.00    -0.153 OA
ATOM     16  O   LIG    1        0.508  -2.526   0.450  0.00  0.00    -0.153 OA
BRANCH  14  17
ATOM     17  N   LIG    1        1.973  -0.587   1.066  0.00  0.00    -0.185 NA
ATOM     18  H   LIG    1        2.525  -0.585   1.922  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        2.670  -0.821  -0.196  0.00  0.00    +0.148 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.803   0.156  -0.274  0.00  0.00    +0.005 A 
ATOM     21  S   LIG    1        3.600   1.656  -1.081  0.00  0.00    -0.100 S 
ATOM     22  C   LIG    1        5.207   2.129  -0.743  0.00  0.00    +0.045 A 
ATOM     23  C   LIG    1        5.891   1.168  -0.032  0.00  0.00    +0.008 A 
ATOM     24  C   LIG    1        5.080   0.028   0.238  0.00  0.00    +0.012 A 
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH  14  17
ENDBRANCH   4  14
TORSDOF 5