REMARK  Name = BDB027176
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        1.803   1.344   2.275  0.00  0.00    +0.059 S 
ATOM      2  O   LIG    1        1.318   2.197   3.335  0.00  0.00    -0.153 OA
ATOM      3  O   LIG    1        2.890   0.412   2.477  0.00  0.00    -0.153 OA
ENDROOT
BRANCH   1   4
ATOM      4  C   LIG    1        0.418   0.484   1.584  0.00  0.00    +0.105 A 
ATOM      5  C   LIG    1       -0.794   1.153   1.429  0.00  0.00    +0.030 A 
ATOM      6  C   LIG    1       -1.888   0.470   0.889  0.00  0.00    +0.025 A 
ATOM      7  C   LIG    1       -1.801  -0.879   0.497  0.00  0.00    +0.030 A 
ATOM      8  C   LIG    1       -0.571  -1.528   0.688  0.00  0.00    +0.025 A 
ATOM      9  C   LIG    1        0.534  -0.858   1.226  0.00  0.00    +0.030 A 
BRANCH   7  10
ATOM     10  N   LIG    1       -2.941  -1.512  -0.029  0.00  0.00    -0.330 N 
ATOM     11  C   LIG    1       -2.983  -2.982   0.011  0.00  0.00    +0.105 C 
ATOM     12  C   LIG    1       -4.406  -3.466  -0.265  0.00  0.00    +0.019 C 
ATOM     13  C   LIG    1       -4.929  -2.915  -1.588  0.00  0.00    +0.003 C 
ATOM     14  C   LIG    1       -4.814  -1.394  -1.618  0.00  0.00    +0.019 C 
ATOM     15  C   LIG    1       -3.388  -0.935  -1.311  0.00  0.00    +0.105 C 
ENDBRANCH   7  10
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  N   LIG    1        2.239   2.368   1.017  0.00  0.00    -0.185 NA
ATOM     17  H   LIG    1        2.352   3.335   1.321  0.00  0.00    +0.148 HD
BRANCH  16  20
ATOM     18  N   LIG    1        5.317   2.094  -0.943  0.00  0.00    -0.268 N 
ATOM     19  C   LIG    1        4.574   1.772   0.313  0.00  0.00    +0.136 C 
ATOM     20  C   LIG    1        3.085   1.847  -0.062  0.00  0.00    +0.096 C 
ATOM     21  C   LIG    1        3.077   2.815  -1.236  0.00  0.00    +0.041 C 
ATOM     22  C   LIG    1        4.331   2.426  -2.000  0.00  0.00    +0.118 C 
BRANCH  18  24
ATOM     23  N   LIG    1        7.665   1.385  -1.403  0.00  0.00    -0.174 NA
ATOM     24  C   LIG    1        6.579   1.717  -1.184  0.00  0.00    +0.169 C 
ENDBRANCH  18  24
ENDBRANCH  16  20
ENDBRANCH   1  16
TORSDOF 5