REMARK  Name = BDB018868
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.167  -1.402  -1.123  0.00  0.00    +0.167 A 
ATOM      2  S   LIG    1        0.040  -2.878  -1.990  0.00  0.00    -0.060 S 
ATOM      3  C   LIG    1        1.577  -3.097  -1.273  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        1.846  -2.050  -0.416  0.00  0.00    +0.098 A 
ATOM      5  N   LIG    1        0.842  -1.099  -0.342  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1        3.075  -1.928   0.361  0.00  0.00    +0.091 A 
ATOM      7  N   LIG    1        3.998  -2.915   0.219  0.00  0.00    -0.253 NA
ATOM      8  C   LIG    1        5.138  -2.810   0.933  0.00  0.00    +0.113 A 
ATOM      9  C   LIG    1        5.412  -1.761   1.790  0.00  0.00    +0.038 A 
ATOM     10  C   LIG    1        4.455  -0.757   1.922  0.00  0.00    +0.055 A 
ATOM     11  C   LIG    1        3.266  -0.837   1.201  0.00  0.00    +0.048 A 
BRANCH  10  12
ATOM     12  C   LIG    1        4.699   0.353   2.795  0.00  0.00    +0.099 C 
ATOM     13  N   LIG    1        4.922   1.244   3.503  0.00  0.00    -0.191 NA
ENDBRANCH  10  12
ENDBRANCH   4   6
BRANCH   1  15
ATOM     14  C   LIG    1       -2.427  -1.128  -2.180  0.00  0.00    +0.140 C 
ATOM     15  N   LIG    1       -1.360  -0.676  -1.284  0.00  0.00    -0.252 N 
ATOM     16  C   LIG    1       -1.501   0.466  -0.467  0.00  0.00    +0.242 C 
ATOM     17  O   LIG    1       -0.583   1.006   0.159  0.00  0.00    -0.273 OA
BRANCH  16  18
ATOM     18  C   LIG    1       -2.912   1.092  -0.381  0.00  0.00    +0.170 C 
ATOM     19  N   LIG    1       -3.172   1.770   0.928  0.00  0.00    -0.258 N 
ATOM     20  C   LIG    1       -3.009   3.238   0.756  0.00  0.00    +0.117 C 
ATOM     21  C   LIG    1       -2.542   3.434  -0.679  0.00  0.00    +0.022 C 
ATOM     22  C   LIG    1       -3.076   2.212  -1.407  0.00  0.00    +0.034 C 
BRANCH  19  23
ATOM     23  C   LIG    1       -3.154   1.143   2.111  0.00  0.00    +0.170 C 
ATOM     24  N   LIG    1       -3.175   0.583   3.123  0.00  0.00    -0.174 NA
ENDBRANCH  19  23
ENDBRANCH  16  18
ENDBRANCH   1  15
TORSDOF 5