REMARK  Name = BDB016164
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.593  -1.210  -1.141  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1       -0.144  -0.022  -1.277  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1       -1.535   0.009  -1.080  0.00  0.00    +0.017 A 
ATOM      4  C   LIG    1       -2.222  -1.189  -0.767  0.00  0.00    +0.036 A 
ATOM      5  C   LIG    1       -1.482  -2.375  -0.652  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1       -0.096  -2.386  -0.828  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  20
ATOM      7  C   LIG    1        2.206   0.976   2.919  0.00  0.00    +0.028 C 
ATOM      8  C   LIG    1        3.159   0.559   1.793  0.00  0.00    +0.076 C 
ATOM      9  N   LIG    1        2.353   0.183   0.640  0.00  0.00    -0.339 N 
ATOM     10  H   LIG    1        1.493  -0.290   0.918  0.00  0.00    +0.146 HD
ATOM     11  C   LIG    1        2.946  -0.500  -0.444  0.00  0.00    +0.057 A 
ATOM     12  C   LIG    1        4.324  -0.464  -0.772  0.00  0.00    +0.055 A 
ATOM     13  C   LIG    1        4.796  -1.220  -1.865  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1        3.938  -1.953  -2.676  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        2.578  -1.933  -2.417  0.00  0.00    +0.010 A 
ATOM     16  N   LIG    1        5.343   0.260  -0.118  0.00  0.00    -0.284 N 
ATOM     17  H   LIG    1        6.291   0.102  -0.440  0.00  0.00    +0.155 HD
ATOM     18  C   LIG    1        5.327   1.217   0.842  0.00  0.00    +0.219 C 
ATOM     19  O   LIG    1        6.405   1.698   1.205  0.00  0.00    -0.275 OA
ATOM     20  C   LIG    1        2.061  -1.209  -1.326  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1        4.042   1.724   1.408  0.00  0.00    +0.118 C 
ENDBRANCH   1  20
BRANCH   3  22
ATOM     22  C   LIG    1       -2.257   1.318  -1.178  0.00  0.00    +0.044 C 
ATOM     23  N   LIG    1       -3.553   1.397  -1.184  0.00  0.00    -0.303 NA
ATOM     24  H   LIG    1       -3.844   2.377  -1.284  0.00  0.00    +0.186 HD
BRANCH  22  25
ATOM     25  C   LIG    1       -1.495   2.595  -1.280  0.00  0.00    +0.038 C 
ATOM     26  C   LIG    1       -0.624   3.058  -0.132  0.00  0.00    +0.010 C 
ATOM     27  C   LIG    1       -1.888   3.795  -0.443  0.00  0.00    +0.010 C 
ENDBRANCH  22  25
ENDBRANCH   3  22
BRANCH   4  28
ATOM     28  N   LIG    1       -3.625  -1.224  -0.601  0.00  0.00    -0.340 N 
ATOM     29  H   LIG    1       -3.984  -0.274  -0.815  0.00  0.00    +0.146 HD
BRANCH  28  30
ATOM     30  C   LIG    1       -4.139  -1.712   0.692  0.00  0.00    +0.081 C 
ATOM     31  C   LIG    1       -3.916  -0.651   1.779  0.00  0.00    +0.029 C 
BRANCH  30  32
ATOM     32  C   LIG    1       -5.634  -2.031   0.515  0.00  0.00    +0.140 C 
BRANCH  32  33
ATOM     33  C   LIG    1       -6.172  -2.744   1.679  0.00  0.00    +0.064 C 
ATOM     34  N   LIG    1       -6.590  -3.306   2.605  0.00  0.00    -0.197 NA
ENDBRANCH  32  33
ENDBRANCH  30  32
ENDBRANCH  28  30
ENDBRANCH   4  28
TORSDOF 7