REMARK  Name = BDB027692
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.447  -1.008  -0.364  0.00  0.00    +0.135 A 
ATOM      2  C   LIG    1       -0.030  -2.350  -0.322  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.311  -2.547   0.009  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        1.740  -3.865   0.048  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        0.978  -4.963  -0.198  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.313  -4.739  -0.496  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.155  -1.541   0.279  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.662  -0.294   0.229  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -0.859  -3.471  -0.570  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.392   0.004  -0.083  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.573   0.825   0.531  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.903   0.607   0.919  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.721   1.693   1.192  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.316   2.976   1.109  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        3.038   3.181   0.734  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        2.148   2.160   0.442  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.788  -0.716  -0.733  0.00  0.00    -0.299 N 
ATOM     18  H   LIG    1       -1.978  -1.135  -1.638  0.00  0.00    +0.154 HD
BRANCH  17  22
ATOM     19  C   LIG    1       -4.026   2.841  -0.245  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -4.314   1.958  -1.281  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1       -3.557   0.793  -1.437  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -2.486   0.504  -0.578  0.00  0.00    +0.032 A 
ATOM     23  C   LIG    1       -2.237   1.387   0.480  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -2.991   2.553   0.640  0.00  0.00    +0.002 A 
ENDBRANCH  17  22
ENDBRANCH   1  17
TORSDOF 3