REMARK  Name = BDB031673
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.262  -1.592  -1.076  0.00  0.00    -0.199 N 
ATOM      2  H   LIG    1        0.234  -2.444  -1.637  0.00  0.00    +0.175 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.531  -1.438  -0.481  0.00  0.00    +0.150 A 
ATOM      4  C   LIG    1        1.837  -0.603   0.591  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1        3.172  -0.592   0.968  0.00  0.00    +0.143 A 
ATOM      6  N   LIG    1        3.315   0.272   2.018  0.00  0.00    -0.346 N 
ATOM      7  H   LIG    1        4.196   0.464   2.473  0.00  0.00    +0.167 HD
ATOM      8  C   LIG    1        2.092   0.798   2.350  0.00  0.00    +0.085 A 
ATOM      9  N   LIG    1        4.170  -1.298   0.417  0.00  0.00    -0.218 NA
ATOM     10  C   LIG    1        3.733  -2.071  -0.593  0.00  0.00    +0.225 A 
ATOM     11  C   LIG    1        1.156   0.267   1.486  0.00  0.00    +0.032 A 
ATOM     12  N   LIG    1        2.478  -2.190  -1.065  0.00  0.00    -0.219 NA
ENDBRANCH   1   3
BRANCH   1  13
ATOM     13  S   LIG    1       -0.259  -0.308  -2.035  0.00  0.00    +0.074 S 
ATOM     14  O   LIG    1       -0.997  -0.892  -3.134  0.00  0.00    -0.150 OA
ATOM     15  O   LIG    1        0.816   0.633  -2.255  0.00  0.00    -0.150 OA
BRANCH  13  18
ATOM     16  C   LIG    1       -3.520   0.325   0.277  0.00  0.00    +0.054 A 
ATOM     17  C   LIG    1       -2.557  -0.283  -0.533  0.00  0.00    +0.047 A 
ATOM     18  C   LIG    1       -1.475   0.472  -0.999  0.00  0.00    +0.110 A 
ATOM     19  C   LIG    1       -1.353   1.827  -0.677  0.00  0.00    +0.029 A 
ATOM     20  C   LIG    1       -2.316   2.429   0.132  0.00  0.00    +0.003 A 
ATOM     21  C   LIG    1       -3.395   1.681   0.610  0.00  0.00    +0.019 A 
BRANCH  16  23
ATOM     22  N   LIG    1       -5.528  -1.052   1.173  0.00  0.00    -0.191 NA
ATOM     23  C   LIG    1       -4.632  -0.435   0.769  0.00  0.00    +0.099 C 
ENDBRANCH  16  23
ENDBRANCH  13  18
ENDBRANCH   1  13
TORSDOF 4