REMARK  Name = BDB015348
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.878   2.162   3.633  0.00  0.00    -0.150 OA
ATOM      2  S   LIG    1        0.303   1.428   2.522  0.00  0.00    +0.077 S 
ATOM      3  O   LIG    1       -0.738   0.452   2.769  0.00  0.00    -0.150 OA
ENDROOT
BRANCH   2   4
ATOM      4  C   LIG    1        1.639   0.576   1.703  0.00  0.00    +0.109 A 
ATOM      5  C   LIG    1        1.347  -0.490   0.849  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1        2.389  -1.164   0.208  0.00  0.00    +0.010 A 
ATOM      7  C   LIG    1        3.726  -0.790   0.422  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        3.998   0.268   1.306  0.00  0.00    +0.010 A 
ATOM      9  C   LIG    1        2.962   0.947   1.951  0.00  0.00    +0.029 A 
BRANCH   7  10
ATOM     10  C   LIG    1        4.819  -1.495  -0.263  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1        5.054  -1.376  -1.643  0.00  0.00    +0.125 A 
ATOM     12  C   LIG    1        6.088  -2.075  -2.265  0.00  0.00    +0.046 A 
ATOM     13  C   LIG    1        6.917  -2.906  -1.515  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        6.709  -3.036  -0.144  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1        5.669  -2.337   0.475  0.00  0.00    +0.012 A 
BRANCH  11  16
ATOM     16  O   LIG    1        4.304  -0.569  -2.457  0.00  0.00    -0.506 OA
ATOM     17  H   LIG    1        3.686  -0.059  -1.907  0.00  0.00    +0.292 HD
ENDBRANCH  11  16
ENDBRANCH   7  10
ENDBRANCH   2   4
BRANCH   2  18
ATOM     18  N   LIG    1       -0.186   2.551   1.352  0.00  0.00    -0.172 N 
ATOM     19  C   LIG    1       -0.641   2.200   0.063  0.00  0.00    +0.201 C 
ATOM     20  N   LIG    1       -0.065   2.841  -0.905  0.00  0.00    -0.253 NA
ATOM     21  C   LIG    1        0.936   3.742  -0.292  0.00  0.00    +0.166 C 
ATOM     22  C   LIG    1        0.688   3.732   1.211  0.00  0.00    +0.158 C 
BRANCH  19  23
ATOM     23  N   LIG    1       -1.627   1.265  -0.079  0.00  0.00    -0.300 N 
ATOM     24  C   LIG    1       -2.783   1.231   0.842  0.00  0.00    +0.123 C 
ATOM     25  C   LIG    1       -4.121   1.369   0.085  0.00  0.00    +0.103 C 
ATOM     26  N   LIG    1       -4.345   0.339  -0.951  0.00  0.00    -0.296 NA
ATOM     27  C   LIG    1       -3.084  -0.225  -1.461  0.00  0.00    +0.103 C 
ATOM     28  C   LIG    1       -1.932   0.801  -1.448  0.00  0.00    +0.123 C 
BRANCH  26  29
ATOM     29  C   LIG    1       -5.404  -0.595  -0.555  0.00  0.00    +0.057 C 
ATOM     30  C   LIG    1       -5.014  -1.568   0.581  0.00  0.00    +0.019 C 
ATOM     31  C   LIG    1       -5.832  -2.637  -0.184  0.00  0.00    +0.003 C 
ATOM     32  C   LIG    1       -5.545  -1.829  -1.474  0.00  0.00    +0.019 C 
ENDBRANCH  26  29
ENDBRANCH  19  23
ENDBRANCH   2  18
TORSDOF 6