REMARK  Name = BDB027167
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        0.035  -1.915   0.745  0.00  0.00    +0.059 S 
ATOM      2  O   LIG    1        1.250  -2.430   1.341  0.00  0.00    -0.153 OA
ATOM      3  O   LIG    1       -0.986  -2.807   0.246  0.00  0.00    -0.153 OA
ENDROOT
BRANCH   1   4
ATOM      4  C   LIG    1       -0.725  -0.790   1.897  0.00  0.00    +0.113 A 
ATOM      5  C   LIG    1       -1.726   0.123   1.509  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.248   0.976   2.505  0.00  0.00    +0.010 A 
ATOM      7  C   LIG    1       -1.795   0.926   3.825  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -0.807   0.018   4.186  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -0.271  -0.839   3.227  0.00  0.00    +0.029 A 
BRANCH   5  10
ATOM     10  C   LIG    1       -2.259   0.258   0.145  0.00  0.00    -0.016 A 
ATOM     11  C   LIG    1       -1.927   1.373  -0.642  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1       -2.431   1.514  -1.937  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -3.283   0.545  -2.461  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -3.636  -0.559  -1.689  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -3.133  -0.698  -0.393  0.00  0.00    +0.008 A 
ENDBRANCH   5  10
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  N   LIG    1        0.509  -0.935  -0.524  0.00  0.00    -0.185 NA
ATOM     17  H   LIG    1        0.102  -1.188  -1.424  0.00  0.00    +0.148 HD
BRANCH  16  20
ATOM     18  N   LIG    1        3.943  -0.150  -1.492  0.00  0.00    -0.268 N 
ATOM     19  C   LIG    1        2.993  -1.065  -0.791  0.00  0.00    +0.136 C 
ATOM     20  C   LIG    1        1.770  -0.199  -0.447  0.00  0.00    +0.096 C 
ATOM     21  C   LIG    1        1.809   0.885  -1.513  0.00  0.00    +0.041 C 
ATOM     22  C   LIG    1        3.294   1.174  -1.644  0.00  0.00    +0.118 C 
BRANCH  18  24
ATOM     23  N   LIG    1        6.408  -0.517  -1.620  0.00  0.00    -0.174 NA
ATOM     24  C   LIG    1        5.264  -0.354  -1.563  0.00  0.00    +0.169 C 
ENDBRANCH  18  24
ENDBRANCH  16  20
ENDBRANCH   1  16
TORSDOF 5