REMARK  Name = BDB056373
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        0.403  -2.615  -0.074  0.00  0.00    -0.078 S 
ENDROOT
BRANCH   1   9
ATOM      2  C   LIG    1        7.561   0.325  -0.938  0.00  0.00    +0.052 C 
ATOM      3  C   LIG    1        6.166  -0.062  -0.568  0.00  0.00    -0.008 A 
ATOM      4  C   LIG    1        5.357   0.472   0.425  0.00  0.00    -0.026 A 
ATOM      5  C   LIG    1        5.739   1.581   1.355  0.00  0.00    +0.045 C 
ATOM      6  C   LIG    1        4.079  -0.188   0.447  0.00  0.00    +0.075 A 
ATOM      7  C   LIG    1        3.965  -1.174  -0.510  0.00  0.00    +0.117 A 
ATOM      8  N   LIG    1        2.884  -1.966  -0.739  0.00  0.00    -0.216 NA
ATOM      9  C   LIG    1        1.890  -1.724   0.050  0.00  0.00    +0.170 A 
ATOM     10  N   LIG    1        1.871  -0.795   1.052  0.00  0.00    -0.301 N 
ATOM     11  H   LIG    1        1.038  -0.669   1.602  0.00  0.00    +0.171 HD
ATOM     12  C   LIG    1        2.932   0.037   1.311  0.00  0.00    +0.261 A 
ATOM     13  O   LIG    1        2.894   0.877   2.204  0.00  0.00    -0.267 OA
ATOM     14  S   LIG    1        5.385  -1.317  -1.435  0.00  0.00    -0.073 S 
ENDBRANCH   1   9
BRANCH   1  15
ATOM     15  C   LIG    1       -0.132  -1.977  -1.691  0.00  0.00    +0.173 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -0.521  -0.513  -1.551  0.00  0.00    +0.226 C 
ATOM     17  N   LIG    1       -1.826  -0.195  -1.207  0.00  0.00    -0.298 N 
ATOM     18  C   LIG    1       -2.181   1.226  -1.157  0.00  0.00    +0.123 C 
ATOM     19  C   LIG    1       -3.670   1.488  -0.871  0.00  0.00    +0.103 C 
ATOM     20  N   LIG    1       -4.109   0.717   0.296  0.00  0.00    -0.297 NA
ATOM     21  C   LIG    1       -3.930  -0.732   0.087  0.00  0.00    +0.103 C 
ATOM     22  C   LIG    1       -2.924  -1.144  -1.016  0.00  0.00    +0.123 C 
ATOM     23  O   LIG    1        0.332   0.366  -1.708  0.00  0.00    -0.275 OA
BRANCH  20  24
ATOM     24  C   LIG    1       -5.463   1.084   0.737  0.00  0.00    +0.112 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -5.878   0.456   2.082  0.00  0.00    +0.171 C 
BRANCH  25  26
ATOM     26  O   LIG    1       -6.311  -0.894   1.933  0.00  0.00    -0.394 OA
ATOM     27  H   LIG    1       -7.106  -0.882   1.373  0.00  0.00    +0.209 HD
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  20  24
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 6