REMARK  Name = BDB015338
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1        0.410  -1.486   2.717  0.00  0.00    +0.077 S 
ATOM      2  O   LIG    1       -0.233  -2.603   2.057  0.00  0.00    -0.150 OA
ATOM      3  O   LIG    1        0.874  -1.631   4.085  0.00  0.00    -0.150 OA
ENDROOT
BRANCH   1   7
ATOM      4  C   LIG    1        4.081  -0.390   0.177  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1        2.917  -0.907  -0.418  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        1.798  -1.237   0.353  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        1.827  -1.034   1.733  0.00  0.00    +0.109 A 
ATOM      8  C   LIG    1        2.979  -0.545   2.351  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        4.094  -0.220   1.573  0.00  0.00    +0.010 A 
BRANCH   4  13
ATOM     10  C   LIG    1        7.513   0.617  -2.204  0.00  0.00    +0.052 A 
ATOM     11  C   LIG    1        6.264   1.167  -2.503  0.00  0.00    +0.019 A 
ATOM     12  C   LIG    1        5.148   0.836  -1.727  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1        5.257  -0.045  -0.638  0.00  0.00    -0.018 A 
ATOM     14  C   LIG    1        6.520  -0.588  -0.352  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1        7.639  -0.262  -1.126  0.00  0.00    +0.019 A 
BRANCH  10  17
ATOM     16  N   LIG    1        9.585   1.228  -3.641  0.00  0.00    -0.191 NA
ATOM     17  C   LIG    1        8.659   0.954  -2.998  0.00  0.00    +0.099 C 
ENDBRANCH  10  17
ENDBRANCH   4  13
ENDBRANCH   1   7
BRANCH   1  18
ATOM     18  N   LIG    1       -0.554  -0.105   2.652  0.00  0.00    -0.172 N 
ATOM     19  C   LIG    1       -1.161   0.452   1.514  0.00  0.00    +0.201 C 
ATOM     20  N   LIG    1       -1.332   1.735   1.566  0.00  0.00    -0.253 NA
ATOM     21  C   LIG    1       -0.887   2.168   2.912  0.00  0.00    +0.166 C 
ATOM     22  C   LIG    1       -0.163   0.989   3.554  0.00  0.00    +0.158 C 
BRANCH  19  23
ATOM     23  N   LIG    1       -1.492  -0.364   0.471  0.00  0.00    -0.300 N 
ATOM     24  C   LIG    1       -1.623   0.245  -0.867  0.00  0.00    +0.123 C 
ATOM     25  C   LIG    1       -3.027   0.848  -1.091  0.00  0.00    +0.103 C 
ATOM     26  N   LIG    1       -4.104  -0.163  -0.915  0.00  0.00    -0.296 NA
ATOM     27  C   LIG    1       -3.962  -0.733   0.451  0.00  0.00    +0.103 C 
ATOM     28  C   LIG    1       -2.568  -1.357   0.695  0.00  0.00    +0.123 C 
BRANCH  26  29
ATOM     29  C   LIG    1       -5.424   0.501  -1.035  0.00  0.00    +0.057 C 
ATOM     30  C   LIG    1       -5.724   0.848  -2.521  0.00  0.00    +0.019 C 
ATOM     31  C   LIG    1       -6.363  -0.543  -2.682  0.00  0.00    +0.003 C 
ATOM     32  C   LIG    1       -6.555  -0.561  -1.155  0.00  0.00    +0.019 C 
ENDBRANCH  26  29
ENDBRANCH  19  23
ENDBRANCH   1  18
TORSDOF 6