REMARK  Name = BDB001793
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.367   0.891   0.825  0.00  0.00    +0.278 A 
ATOM      2  O   LIG    1       -0.183   0.259   1.099  0.00  0.00    -0.414 OA
ATOM      3  C   LIG    1        0.381   0.170  -0.144  0.00  0.00    +0.235 A 
ATOM      4  N   LIG    1       -0.363   0.713  -1.087  0.00  0.00    -0.110 NA
ATOM      5  N   LIG    1       -1.493   1.185  -0.455  0.00  0.00    -0.101 NA
ENDROOT
BRANCH   1   6
ATOM      6  S   LIG    1       -2.531   1.285   2.051  0.00  0.00    -0.056 S 
BRANCH   6   7
ATOM      7  C   LIG    1       -4.033   1.369   1.031  0.00  0.00    +0.174 C 
BRANCH   7  10
ATOM      8  C   LIG    1       -5.605  -1.189  -1.344  0.00  0.00    +0.131 C 
ATOM      9  N   LIG    1       -5.362   0.042  -0.608  0.00  0.00    -0.307 N 
ATOM     10  C   LIG    1       -4.397   0.022   0.405  0.00  0.00    +0.225 C 
ATOM     11  O   LIG    1       -3.894  -1.036   0.791  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -5.871   1.261  -1.216  0.00  0.00    +0.131 C 
ENDBRANCH   7  10
ENDBRANCH   6   7
ENDBRANCH   1   6
BRANCH   3  13
ATOM     13  C   LIG    1        1.711  -0.511  -0.253  0.00  0.00    +0.144 C 
BRANCH  13  14
ATOM     14  N   LIG    1        1.725  -1.455  -1.395  0.00  0.00    -0.320 NA
ATOM     15  H   LIG    1        0.989  -2.147  -1.248  0.00  0.00    +0.119 HD
ATOM     16  H   LIG    1        1.449  -0.943  -2.235  0.00  0.00    +0.119 HD
ENDBRANCH  13  14
BRANCH  13  17
ATOM     17  C   LIG    1        2.821   0.554  -0.387  0.00  0.00    +0.063 C 
BRANCH  17  18
ATOM     18  C   LIG    1        4.197   0.043  -0.023  0.00  0.00    -0.045 A 
ATOM     19  C   LIG    1        4.707   0.236   1.269  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1        5.973  -0.244   1.608  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        6.739  -0.924   0.663  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        6.239  -1.126  -0.621  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        4.974  -0.647  -0.963  0.00  0.00    +0.004 A 
ENDBRANCH  17  18
ENDBRANCH  13  17
ENDBRANCH   3  13
TORSDOF 7