REMARK  Name = BDB027170
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        1.491   0.001  -2.861  0.00  0.00    +0.059 S 
ATOM      2  O   LIG    1        1.517   1.211  -3.651  0.00  0.00    -0.153 OA
ATOM      3  O   LIG    1        1.579  -1.311  -3.462  0.00  0.00    -0.153 OA
ENDROOT
BRANCH   1   4
ATOM      4  C   LIG    1        0.043   0.049  -1.837  0.00  0.00    +0.105 A 
ATOM      5  C   LIG    1       -0.633  -1.132  -1.526  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1       -1.766  -1.080  -0.709  0.00  0.00    +0.010 A 
ATOM      7  C   LIG    1       -2.242   0.142  -0.202  0.00  0.00    -0.018 A 
ATOM      8  C   LIG    1       -1.553   1.319  -0.548  0.00  0.00    +0.010 A 
ATOM      9  C   LIG    1       -0.420   1.278  -1.365  0.00  0.00    +0.029 A 
BRANCH   7  10
ATOM     10  C   LIG    1       -3.433   0.190   0.662  0.00  0.00    -0.018 A 
ATOM     11  C   LIG    1       -3.391   0.818   1.918  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1       -4.520   0.862   2.740  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -5.713   0.280   2.318  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -5.777  -0.345   1.076  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -4.646  -0.390   0.256  0.00  0.00    +0.008 A 
ENDBRANCH   7  10
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  N   LIG    1        2.730   0.134  -1.744  0.00  0.00    -0.185 NA
ATOM     17  H   LIG    1        3.037   1.087  -1.551  0.00  0.00    +0.148 HD
BRANCH  16  20
ATOM     18  N   LIG    1        3.718   0.447   1.102  0.00  0.00    -0.268 N 
ATOM     19  C   LIG    1        2.541  -0.367   0.679  0.00  0.00    +0.136 C 
ATOM     20  C   LIG    1        2.921  -0.897  -0.708  0.00  0.00    +0.096 C 
ATOM     21  C   LIG    1        4.411  -1.162  -0.541  0.00  0.00    +0.041 C 
ATOM     22  C   LIG    1        4.903   0.002   0.314  0.00  0.00    +0.118 C 
BRANCH  18  24
ATOM     23  N   LIG    1        3.852   1.673   3.271  0.00  0.00    -0.174 NA
ATOM     24  C   LIG    1        3.793   1.107   2.263  0.00  0.00    +0.169 C 
ENDBRANCH  18  24
ENDBRANCH  16  20
ENDBRANCH   1  16
TORSDOF 5