REMARK  Name = BDB063115
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.496  -1.141  -2.914  0.00  0.00    -0.268 N 
ATOM      2  H   LIG    1       -1.095  -0.883  -3.804  0.00  0.00    +0.156 HD
ENDROOT
BRANCH   1   7
ATOM      3  C   LIG    1       -6.815   0.618  -3.265  0.00  0.00    +0.047 C 
ATOM      4  C   LIG    1       -5.416   0.117  -3.119  0.00  0.00    -0.006 A 
ATOM      5  C   LIG    1       -4.894  -0.426  -1.955  0.00  0.00    +0.079 A 
ATOM      6  N   LIG    1       -3.613  -0.842  -1.866  0.00  0.00    -0.214 NA
ATOM      7  C   LIG    1       -2.824  -0.720  -2.939  0.00  0.00    +0.221 A 
ATOM      8  N   LIG    1       -3.259  -0.263  -4.124  0.00  0.00    -0.222 NA
ATOM      9  C   LIG    1       -4.538   0.151  -4.182  0.00  0.00    +0.120 A 
BRANCH   5  10
ATOM     10  C   LIG    1       -5.658  -0.591  -0.707  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1       -5.216   0.035   0.474  0.00  0.00    +0.039 A 
ATOM     12  C   LIG    1       -5.933  -0.105   1.680  0.00  0.00    +0.079 A 
ATOM     13  C   LIG    1       -7.086  -0.893   1.686  0.00  0.00    +0.039 A 
ATOM     14  S   LIG    1       -7.758  -0.896   3.273  0.00  0.00    -0.075 S 
ATOM     15  C   LIG    1       -6.490   0.125   3.801  0.00  0.00    +0.157 A 
ATOM     16  C   LIG    1       -7.543  -1.546   0.532  0.00  0.00    +0.018 A 
ATOM     17  N   LIG    1       -5.607   0.476   2.896  0.00  0.00    -0.247 NA
ATOM     18  C   LIG    1       -6.813  -1.385  -0.652  0.00  0.00    +0.011 A 
ENDBRANCH   5  10
ENDBRANCH   1   7
BRANCH   1  19
ATOM     19  C   LIG    1       -0.588  -0.949  -1.859  0.00  0.00    +0.125 A 
ATOM     20  N   LIG    1       -0.895  -0.176  -0.798  0.00  0.00    -0.240 NA
ATOM     21  C   LIG    1        0.025  -0.036   0.185  0.00  0.00    +0.117 A 
ATOM     22  C   LIG    1        1.279  -0.632   0.173  0.00  0.00    -0.015 A 
ATOM     23  C   LIG    1        1.592  -1.423  -0.930  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1        0.654  -1.581  -1.951  0.00  0.00    +0.044 A 
BRANCH  22  25
ATOM     25  C   LIG    1        2.244  -0.446   1.317  0.00  0.00    +0.121 C 
BRANCH  25  26
ATOM     26  N   LIG    1        2.606   0.964   1.558  0.00  0.00    -0.296 NA
ATOM     27  C   LIG    1        3.364   1.546   0.432  0.00  0.00    +0.100 C 
ATOM     28  C   LIG    1        4.768   0.930   0.186  0.00  0.00    +0.100 C 
ATOM     29  N   LIG    1        5.391   0.353   1.392  0.00  0.00    -0.297 NA
ATOM     30  C   LIG    1        4.969   1.080   2.595  0.00  0.00    +0.100 C 
ATOM     31  C   LIG    1        3.426   1.081   2.788  0.00  0.00    +0.100 C 
BRANCH  29  32
ATOM     32  C   LIG    1        6.840   0.112   1.312  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1        7.178  -0.853   0.169  0.00  0.00    +0.024 C 
ATOM     34  C   LIG    1        7.711   1.370   1.211  0.00  0.00    +0.024 C 
ENDBRANCH  29  32
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH   1  19
TORSDOF 6