REMARK  Name = BDB051862
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.876   0.539  -2.185  0.00  0.00    +0.049 A 
ATOM      2  C   LIG    1        1.670   0.779  -1.536  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1        0.430  -0.013  -1.408  0.00  0.00    +0.248 C 
ATOM      4  N   LIG    1       -0.464   0.728  -0.658  0.00  0.00    -0.293 N 
ATOM      5  C   LIG    1        0.080   1.995  -0.224  0.00  0.00    +0.144 C 
ATOM      6  O   LIG    1        0.235  -1.119  -1.877  0.00  0.00    -0.270 OA
ATOM      7  C   LIG    1        1.443   1.978  -0.832  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1        2.407   2.971  -0.755  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1        3.620   2.755  -1.401  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        3.848   1.560  -2.104  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  14
ATOM     11  N   LIG    1        2.482  -1.781  -2.942  0.00  0.00    -0.325 N 
ATOM     12  H   LIG    1        2.742  -2.548  -3.547  0.00  0.00    +0.145 HD
ATOM     13  H   LIG    1        1.542  -1.802  -2.551  0.00  0.00    +0.145 HD
ATOM     14  C   LIG    1        3.267  -0.672  -2.962  0.00  0.00    +0.242 C 
ATOM     15  O   LIG    1        4.307  -0.686  -3.616  0.00  0.00    -0.270 OA
ENDBRANCH   1  14
BRANCH   4  16
ATOM     16  C   LIG    1       -1.795   0.282  -0.281  0.00  0.00    +0.113 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -1.895  -0.150   1.190  0.00  0.00    +0.020 C 
ATOM     18  C   LIG    1       -3.345  -0.497   1.551  0.00  0.00    +0.086 C 
ATOM     19  N   LIG    1       -3.524  -0.774   2.979  0.00  0.00    -0.316 NA
ATOM     20  H   LIG    1       -4.332  -1.385   3.100  0.00  0.00    +0.122 HD
ATOM     21  C   LIG    1       -2.352  -1.365   3.628  0.00  0.00    +0.081 C 
ATOM     22  C   LIG    1       -1.487  -2.184   2.678  0.00  0.00    +0.015 C 
ATOM     23  C   LIG    1       -0.973  -1.341   1.510  0.00  0.00    +0.007 C 
ENDBRANCH  16  17
ENDBRANCH   4  16
TORSDOF 3