REMARK  Name = BDB045059
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1       -0.384   0.131   1.449  0.00  0.00    -0.027 S 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.662   0.724   0.370  0.00  0.00    +0.120 C 
ATOM      3  S   LIG    1       -1.387   2.203  -0.398  0.00  0.00    -0.027 S 
BRANCH   2   4
ATOM      4  N   LIG    1       -2.841  -0.043   0.266  0.00  0.00    -0.319 N 
BRANCH   4   6
ATOM      5  C   LIG    1       -3.701  -0.349  -2.037  0.00  0.00    +0.024 C 
ATOM      6  C   LIG    1       -3.910   0.314  -0.684  0.00  0.00    +0.103 C 
ENDBRANCH   4   6
BRANCH   4   7
ATOM      7  C   LIG    1       -3.145  -1.212   1.110  0.00  0.00    +0.103 C 
ATOM      8  C   LIG    1       -3.834  -0.803   2.404  0.00  0.00    +0.024 C 
ENDBRANCH   4   7
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1   9
ATOM      9  S   LIG    1        0.475  -1.382   0.337  0.00  0.00    -0.027 S 
BRANCH   9  10
ATOM     10  C   LIG    1        1.485  -0.501  -0.827  0.00  0.00    +0.120 C 
ATOM     11  S   LIG    1        0.935  -0.465  -2.425  0.00  0.00    -0.027 S 
BRANCH  10  12
ATOM     12  N   LIG    1        2.699   0.058  -0.368  0.00  0.00    -0.319 N 
BRANCH  12  13
ATOM     13  C   LIG    1        3.551   0.861  -1.268  0.00  0.00    +0.103 C 
ATOM     14  C   LIG    1        4.580   0.018  -2.010  0.00  0.00    +0.024 C 
ENDBRANCH  12  13
BRANCH  12  15
ATOM     15  C   LIG    1        3.287  -0.217   0.958  0.00  0.00    +0.103 C 
ATOM     16  C   LIG    1        3.265   0.991   1.885  0.00  0.00    +0.024 C 
ENDBRANCH  12  15
ENDBRANCH  10  12
ENDBRANCH   9  10
ENDBRANCH   1   9
TORSDOF 9