REMARK  Name = BDB015363
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.126   0.753   2.845  0.00  0.00    -0.150 OA
ATOM      2  S   LIG    1        0.943  -0.430   2.681  0.00  0.00    +0.077 S 
ATOM      3  O   LIG    1        1.459  -1.119   3.849  0.00  0.00    -0.150 OA
ENDROOT
BRANCH   2   4
ATOM      4  C   LIG    1        2.346   0.042   1.686  0.00  0.00    +0.109 A 
ATOM      5  C   LIG    1        3.607  -0.494   1.950  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1        4.699  -0.102   1.170  0.00  0.00    +0.010 A 
ATOM      7  C   LIG    1        4.554   0.834   0.130  0.00  0.00    -0.015 A 
ATOM      8  C   LIG    1        3.276   1.375  -0.100  0.00  0.00    +0.010 A 
ATOM      9  C   LIG    1        2.179   0.991   0.676  0.00  0.00    +0.029 A 
BRANCH   7  10
ATOM     10  C   LIG    1        5.703   1.240  -0.688  0.00  0.00    +0.018 A 
ATOM     11  C   LIG    1        5.678   1.262  -2.073  0.00  0.00    +0.122 A 
ATOM     12  N   LIG    1        6.717   1.629  -2.855  0.00  0.00    -0.243 NA
ATOM     13  C   LIG    1        7.833   1.987  -2.205  0.00  0.00    +0.221 A 
ATOM     14  N   LIG    1        7.994   2.010  -0.875  0.00  0.00    -0.243 NA
ATOM     15  C   LIG    1        6.917   1.636  -0.150  0.00  0.00    +0.122 A 
ENDBRANCH   7  10
ENDBRANCH   2   4
BRANCH   2  16
ATOM     16  N   LIG    1        0.176  -1.579   1.708  0.00  0.00    -0.172 N 
ATOM     17  C   LIG    1       -0.407  -1.308   0.458  0.00  0.00    +0.201 C 
ATOM     18  N   LIG    1       -0.135  -2.171  -0.468  0.00  0.00    -0.253 NA
ATOM     19  C   LIG    1        0.779  -3.169   0.134  0.00  0.00    +0.166 C 
ATOM     20  C   LIG    1        0.825  -2.898   1.635  0.00  0.00    +0.158 C 
BRANCH  17  21
ATOM     21  N   LIG    1       -1.215  -0.213   0.335  0.00  0.00    -0.300 N 
ATOM     22  C   LIG    1       -1.476   0.309  -1.022  0.00  0.00    +0.123 C 
ATOM     23  C   LIG    1       -2.908  -0.024  -1.480  0.00  0.00    +0.103 C 
ATOM     24  N   LIG    1       -3.958   0.631  -0.654  0.00  0.00    -0.296 NA
ATOM     25  C   LIG    1       -3.453   0.859   0.726  0.00  0.00    +0.103 C 
ATOM     26  C   LIG    1       -2.407  -0.163   1.217  0.00  0.00    +0.123 C 
BRANCH  24  27
ATOM     27  C   LIG    1       -5.170  -0.218  -0.618  0.00  0.00    +0.057 C 
ATOM     28  C   LIG    1       -5.834  -0.294  -2.022  0.00  0.00    +0.019 C 
ATOM     29  C   LIG    1       -6.634   0.975  -1.676  0.00  0.00    +0.003 C 
ATOM     30  C   LIG    1       -6.391   0.646  -0.191  0.00  0.00    +0.019 C 
ENDBRANCH  24  27
ENDBRANCH  17  21
ENDBRANCH   2  16
TORSDOF 5