REMARK  Name = BDB015346
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        0.632  -1.497   2.499  0.00  0.00    +0.077 S 
ATOM      2  O   LIG    1        1.200  -2.514   3.364  0.00  0.00    -0.150 OA
ATOM      3  O   LIG    1       -0.113  -0.399   3.076  0.00  0.00    -0.150 OA
ENDROOT
BRANCH   1   7
ATOM      4  C   LIG    1        4.092   0.371   0.121  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1        4.269  -0.838   0.818  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        3.222  -1.414   1.544  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        1.976  -0.786   1.567  0.00  0.00    +0.109 A 
ATOM      8  C   LIG    1        1.780   0.427   0.904  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        2.832   0.994   0.179  0.00  0.00    +0.010 A 
BRANCH   4  12
ATOM     10  C   LIG    1        7.489   1.806  -0.769  0.00  0.00    +0.052 A 
ATOM     11  C   LIG    1        6.438   1.233  -0.040  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1        5.196   0.972  -0.645  0.00  0.00    -0.017 A 
ATOM     13  C   LIG    1        5.039   1.302  -2.001  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        6.084   1.873  -2.732  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        7.308   2.125  -2.117  0.00  0.00    +0.019 A 
BRANCH  10  17
ATOM     16  N   LIG    1        9.766   2.270   0.383  0.00  0.00    -0.191 NA
ATOM     17  C   LIG    1        8.747   2.064  -0.132  0.00  0.00    +0.099 C 
ENDBRANCH  10  17
ENDBRANCH   4  12
ENDBRANCH   1   7
BRANCH   1  18
ATOM     18  N   LIG    1       -0.269  -2.284   1.302  0.00  0.00    -0.172 N 
ATOM     19  C   LIG    1       -0.891  -1.640   0.214  0.00  0.00    +0.201 C 
ATOM     20  N   LIG    1       -0.676  -2.197  -0.936  0.00  0.00    -0.253 NA
ATOM     21  C   LIG    1        0.223  -3.349  -0.697  0.00  0.00    +0.166 C 
ATOM     22  C   LIG    1        0.304  -3.550   0.812  0.00  0.00    +0.158 C 
BRANCH  19  23
ATOM     23  N   LIG    1       -1.667  -0.535   0.427  0.00  0.00    -0.300 N 
ATOM     24  C   LIG    1       -2.599  -0.468   1.572  0.00  0.00    +0.123 C 
ATOM     25  C   LIG    1       -4.057  -0.321   1.089  0.00  0.00    +0.103 C 
ATOM     26  N   LIG    1       -4.309   0.930   0.329  0.00  0.00    -0.296 NA
ATOM     27  C   LIG    1       -3.081   1.360  -0.383  0.00  0.00    +0.103 C 
ATOM     28  C   LIG    1       -2.122   0.216  -0.761  0.00  0.00    +0.123 C 
BRANCH  26  29
ATOM     29  C   LIG    1       -5.406   0.710  -0.625  0.00  0.00    +0.057 C 
ATOM     30  C   LIG    1       -6.748   0.534   0.136  0.00  0.00    +0.019 C 
ATOM     31  C   LIG    1       -7.377   1.458  -0.928  0.00  0.00    +0.003 C 
ATOM     32  C   LIG    1       -5.973   2.076  -1.100  0.00  0.00    +0.019 C 
ENDBRANCH  26  29
ENDBRANCH  19  23
ENDBRANCH   1  18
TORSDOF 6