REMARK  Name = BDB003268
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.701  -0.276   0.329  0.00  0.00    -0.297 N 
ATOM      2  H   LIG    1       -1.131  -0.053  -0.555  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   6
ATOM      3  C   LIG    1        3.545  -0.155  -0.006  0.00  0.00    +0.007 A 
ATOM      4  C   LIG    1        2.695   0.272  -1.035  0.00  0.00    +0.012 A 
ATOM      5  C   LIG    1        1.301   0.218  -0.888  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1        0.712  -0.249   0.293  0.00  0.00    +0.033 A 
ATOM      7  C   LIG    1        1.549  -0.699   1.310  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1        2.944  -0.647   1.163  0.00  0.00    +0.012 A 
BRANCH   3  15
ATOM      9  C   LIG    1       11.155   0.289  -0.933  0.00  0.00    +0.044 C 
ATOM     10  C   LIG    1        9.759   0.041  -0.437  0.00  0.00    -0.049 A 
ATOM     11  C   LIG    1        8.659   0.497  -1.181  0.00  0.00    +0.020 A 
ATOM     12  C   LIG    1        7.364   0.224  -0.708  0.00  0.00    +0.040 A 
ATOM     13  C   LIG    1        7.144  -0.493   0.465  0.00  0.00    +0.079 A 
ATOM     14  N   LIG    1        5.815  -0.683   0.802  0.00  0.00    -0.239 NA
ATOM     15  C   LIG    1        5.021  -0.129  -0.094  0.00  0.00    +0.109 A 
ATOM     16  C   LIG    1        8.256  -0.958   1.194  0.00  0.00    +0.029 A 
ATOM     17  S   LIG    1        5.846   0.657  -1.387  0.00  0.00    -0.067 S 
ATOM     18  C   LIG    1        9.551  -0.692   0.734  0.00  0.00    +0.005 A 
ENDBRANCH   3  15
ENDBRANCH   1   6
BRANCH   1  19
ATOM     19  C   LIG    1       -1.595  -0.405   1.360  0.00  0.00    +0.135 C 
ATOM     20  S   LIG    1       -1.332  -0.319   3.007  0.00  0.00    -0.019 S 
BRANCH  19  21
ATOM     21  N   LIG    1       -2.897  -0.613   0.988  0.00  0.00    -0.323 N 
ATOM     22  H   LIG    1       -3.512  -0.691   1.789  0.00  0.00    +0.148 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -3.499  -0.737  -0.339  0.00  0.00    +0.075 C 
ATOM     24  C   LIG    1       -3.723   0.608  -1.036  0.00  0.00    +0.044 C 
ATOM     25  C   LIG    1       -4.970   1.381  -0.565  0.00  0.00    +0.016 C 
ATOM     26  C   LIG    1       -5.281   2.466  -1.622  0.00  0.00    +0.027 C 
ATOM     27  C   LIG    1       -4.722   2.121   0.761  0.00  0.00    +0.027 C 
ATOM     28  N   LIG    1       -6.161   0.529  -0.522  0.00  0.00    -0.306 NA
ATOM     29  H   LIG    1       -6.957   1.043  -0.142  0.00  0.00    +0.123 HD
ATOM     30  C   LIG    1       -6.068  -0.801   0.084  0.00  0.00    +0.016 C 
ATOM     31  C   LIG    1       -7.279  -1.588  -0.472  0.00  0.00    +0.027 C 
ATOM     32  C   LIG    1       -6.254  -0.754   1.611  0.00  0.00    +0.027 C 
ATOM     33  C   LIG    1       -4.790  -1.560  -0.332  0.00  0.00    +0.044 C 
ENDBRANCH  21  23
ENDBRANCH  19  21
ENDBRANCH   1  19
TORSDOF 5