REMARK  Name = BDB000484
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.571   4.240  -0.640  0.00  0.00    +0.232 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        0.608   2.965  -1.268  0.00  0.00    -0.488 OA
BRANCH   2   4
ATOM      3  C   LIG    1        1.542   0.831  -1.606  0.00  0.00    +0.162 A 
ATOM      4  C   LIG    1        1.640   2.103  -1.010  0.00  0.00    +0.162 A 
ATOM      5  C   LIG    1        2.746   2.396  -0.214  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        3.743   1.435  -0.009  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        3.665   0.162  -0.594  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1        2.553  -0.121  -1.403  0.00  0.00    +0.060 A 
BRANCH   7   9
ATOM      9  C   LIG    1        4.758  -0.801  -0.339  0.00  0.00    +0.109 A 
ATOM     10  S   LIG    1        4.606  -2.499  -0.756  0.00  0.00    -0.072 S 
ATOM     11  C   LIG    1        6.139  -2.747  -0.149  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1        7.018  -3.923  -0.013  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1        8.375  -3.232   0.357  0.00  0.00    +0.011 C 
ATOM     14  C   LIG    1        8.037  -1.795   0.878  0.00  0.00    +0.056 C 
ATOM     15  C   LIG    1        6.681  -1.593   0.329  0.00  0.00    +0.052 A 
ATOM     16  N   LIG    1        5.914  -0.474   0.237  0.00  0.00    -0.244 NA
ENDBRANCH   7   9
BRANCH   3  18
ATOM     17  C   LIG    1        0.097  -0.733  -2.683  0.00  0.00    +0.277 C 
ATOM     18  O   LIG    1        0.437   0.616  -2.395  0.00  0.00    -0.491 OA
ENDBRANCH   3  18
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  19
ATOM     19  C   LIG    1        0.029   4.206   0.793  0.00  0.00    +0.082 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.328   3.510   0.905  0.00  0.00    +0.232 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.123   2.099   0.929  0.00  0.00    -0.492 OA
BRANCH  21  22
ATOM     22  C   LIG    1       -2.233   1.302   0.883  0.00  0.00    +0.121 A 
ATOM     23  C   LIG    1       -3.556   1.735   0.996  0.00  0.00    +0.049 A 
ATOM     24  C   LIG    1       -4.569   0.788   0.936  0.00  0.00    -0.040 A 
ATOM     25  C   LIG    1       -6.045   1.024   1.005  0.00  0.00    +0.036 C 
ATOM     26  C   LIG    1       -6.559  -0.393   1.301  0.00  0.00    +0.013 C 
ATOM     27  C   LIG    1       -5.549  -1.384   0.674  0.00  0.00    +0.030 C 
ATOM     28  C   LIG    1       -4.285  -0.569   0.753  0.00  0.00    -0.040 A 
ATOM     29  C   LIG    1       -2.979  -1.013   0.647  0.00  0.00    +0.008 A 
ATOM     30  C   LIG    1       -1.954  -0.067   0.719  0.00  0.00    +0.046 A 
BRANCH  27  31
ATOM     31  C   LIG    1       -5.876  -1.744  -0.778  0.00  0.00    +0.128 C 
BRANCH  31  32
ATOM     32  C   LIG    1       -7.047  -2.689  -0.878  0.00  0.00    +0.305 C 
ATOM     33  O   LIG    1       -7.644  -3.181   0.065  0.00  0.00    -0.251 OA
BRANCH  32  34
ATOM     34  O   LIG    1       -7.382  -2.956  -2.163  0.00  0.00    -0.481 OA
ATOM     35  H   LIG    1       -6.820  -2.501  -2.819  0.00  0.00    +0.295 HD
ENDBRANCH  32  34
ENDBRANCH  31  32
ENDBRANCH  27  31
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 11