REMARK  Name = BDB015430
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.635  -1.526  -0.999  0.00  0.00    -0.172 N 
ATOM      2  C   LIG    1        0.275  -1.898  -1.061  0.00  0.00    +0.201 C 
ATOM      3  N   LIG    1        0.060  -3.164  -1.232  0.00  0.00    -0.253 NA
ATOM      4  C   LIG    1        1.389  -3.796  -1.399  0.00  0.00    +0.166 C 
ATOM      5  C   LIG    1        2.428  -2.771  -0.959  0.00  0.00    +0.158 C 
ENDROOT
BRANCH   2   6
ATOM      6  N   LIG    1       -0.672  -0.931  -0.879  0.00  0.00    -0.300 N 
ATOM      7  C   LIG    1       -0.570  -0.066   0.315  0.00  0.00    +0.123 C 
ATOM      8  C   LIG    1       -1.888   0.679   0.609  0.00  0.00    +0.103 C 
ATOM      9  N   LIG    1       -3.013  -0.245   0.856  0.00  0.00    -0.296 NA
ATOM     10  C   LIG    1       -2.991  -1.392  -0.079  0.00  0.00    +0.103 C 
ATOM     11  C   LIG    1       -2.057  -1.218  -1.295  0.00  0.00    +0.123 C 
BRANCH   9  12
ATOM     12  C   LIG    1       -4.295   0.454   0.974  0.00  0.00    +0.057 C 
ATOM     13  C   LIG    1       -4.872   1.080  -0.308  0.00  0.00    +0.025 C 
ATOM     14  C   LIG    1       -6.378   1.208  -0.024  0.00  0.00    -0.033 C 
ATOM     15  C   LIG    1       -7.183   1.323  -1.321  0.00  0.00    +0.011 C 
ATOM     16  C   LIG    1       -6.689   2.422   0.868  0.00  0.00    +0.011 C 
ATOM     17  C   LIG    1       -6.676  -0.108   0.710  0.00  0.00    +0.008 C 
ATOM     18  C   LIG    1       -5.433  -0.413   1.550  0.00  0.00    +0.019 C 
ENDBRANCH   9  12
ENDBRANCH   2   6
BRANCH   1  19
ATOM     19  S   LIG    1        2.266  -0.305  -1.997  0.00  0.00    +0.077 S 
ATOM     20  O   LIG    1        1.482   0.909  -1.912  0.00  0.00    -0.150 OA
ATOM     21  O   LIG    1        2.590  -0.899  -3.280  0.00  0.00    -0.150 OA
BRANCH  19  25
ATOM     22  C   LIG    1        6.211   0.621   0.148  0.00  0.00    -0.045 A 
ATOM     23  C   LIG    1        4.976   0.871   0.771  0.00  0.00    +0.006 A 
ATOM     24  C   LIG    1        3.777   0.592   0.114  0.00  0.00    +0.029 A 
ATOM     25  C   LIG    1        3.808   0.056  -1.175  0.00  0.00    +0.109 A 
ATOM     26  C   LIG    1        5.022  -0.191  -1.817  0.00  0.00    +0.029 A 
ATOM     27  C   LIG    1        6.218   0.090  -1.153  0.00  0.00    +0.006 A 
BRANCH  22  29
ATOM     28  C   LIG    1        7.680   2.415   1.140  0.00  0.00    +0.012 C 
ATOM     29  C   LIG    1        7.528   0.921   0.844  0.00  0.00    +0.013 C 
ATOM     30  C   LIG    1        7.691   0.092   2.121  0.00  0.00    +0.012 C 
ENDBRANCH  22  29
ENDBRANCH  19  25
ENDBRANCH   1  19
TORSDOF 5