REMARK  Name = BDB051706
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.795  -2.529  -0.204  0.00  0.00    +0.173 C 
ATOM      2  N   LIG    1       -1.799  -1.610   0.276  0.00  0.00    -0.264 N 
ATOM      3  C   LIG    1       -1.793  -0.250   0.200  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1       -0.806   0.654  -0.358  0.00  0.00    +0.097 A 
ATOM      5  C   LIG    1       -0.930   1.998  -0.040  0.00  0.00    -0.001 A 
ATOM      6  C   LIG    1       -1.980   2.493   0.923  0.00  0.00    +0.043 C 
ATOM      7  C   LIG    1       -3.264   1.623   0.970  0.00  0.00    +0.044 C 
ATOM      8  C   LIG    1        0.033   2.800  -0.596  0.00  0.00    +0.120 A 
ATOM      9  N   LIG    1        1.003   2.333  -1.404  0.00  0.00    -0.223 NA
ATOM     10  C   LIG    1        1.028   1.012  -1.643  0.00  0.00    +0.216 A 
ATOM     11  N   LIG    1        0.137   0.139  -1.159  0.00  0.00    -0.213 NA
ATOM     12  C   LIG    1       -2.945   0.172   0.837  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -3.611  -1.014   1.255  0.00  0.00    +0.151 A 
ATOM     14  N   LIG    1       -2.888  -2.097   0.908  0.00  0.00    -0.166 NA
ENDROOT
BRANCH  13  15
ATOM     15  C   LIG    1       -4.897  -1.151   1.958  0.00  0.00    +0.262 C 
ATOM     16  O   LIG    1       -5.190  -2.069   2.719  0.00  0.00    -0.269 OA
ATOM     17  N   LIG    1       -5.829  -0.179   1.684  0.00  0.00    -0.324 N 
ATOM     18  H   LIG    1       -5.762   0.327   0.813  0.00  0.00    +0.145 HD
ATOM     19  H   LIG    1       -6.758  -0.399   2.018  0.00  0.00    +0.145 HD
ENDBRANCH  13  15
BRANCH  10  20
ATOM     20  N   LIG    1        2.000   0.470  -2.479  0.00  0.00    -0.308 N 
ATOM     21  H   LIG    1        1.860  -0.531  -2.394  0.00  0.00    +0.149 HD
BRANCH  20  22
ATOM     22  C   LIG    1        3.350   0.885  -2.107  0.00  0.00    +0.160 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.917   0.025  -0.988  0.00  0.00    +0.058 A 
ATOM     24  N   LIG    1        3.863   0.514   0.277  0.00  0.00    -0.258 NA
ATOM     25  C   LIG    1        4.330  -0.273   1.270  0.00  0.00    +0.111 A 
ATOM     26  C   LIG    1        4.853  -1.538   1.070  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        4.901  -2.030  -0.229  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1        4.425  -1.243  -1.274  0.00  0.00    +0.025 A 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH  10  20
TORSDOF 4