REMARK  Name = BDB059635
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.016  -0.071   0.599  0.00  0.00    +0.060 A 
ATOM      2  C   LIG    1       -2.274   0.300   0.237  0.00  0.00    +0.045 A 
ATOM      3  C   LIG    1       -3.432  -0.543   0.739  0.00  0.00    +0.279 A 
ATOM      4  O   LIG    1       -4.611  -0.297   0.513  0.00  0.00    -0.265 OA
ATOM      5  N   LIG    1       -3.069  -1.659   1.509  0.00  0.00    -0.179 N 
ATOM      6  C   LIG    1       -1.773  -1.999   1.829  0.00  0.00    +0.156 A 
ATOM      7  C   LIG    1       -1.841  -3.142   2.585  0.00  0.00    +0.114 A 
ATOM      8  C   LIG    1       -3.215  -3.427   2.679  0.00  0.00    +0.156 A 
ATOM      9  N   LIG    1       -3.972  -2.535   2.032  0.00  0.00    -0.169 NA
ATOM     10  N   LIG    1       -0.781  -1.205   1.376  0.00  0.00    -0.338 N 
ATOM     11  H   LIG    1        0.204  -1.391   1.576  0.00  0.00    +0.167 HD
ENDROOT
BRANCH   1  15
ATOM     12  N   LIG    1        2.095   1.200  -0.625  0.00  0.00    -0.269 N 
ATOM     13  N   LIG    1        1.812   2.225   0.204  0.00  0.00    -0.179 NA
ATOM     14  C   LIG    1        0.639   1.880   0.744  0.00  0.00    +0.144 A 
ATOM     15  C   LIG    1        0.161   0.655   0.239  0.00  0.00    +0.036 A 
ATOM     16  C   LIG    1        1.135   0.228  -0.634  0.00  0.00    +0.118 A 
BRANCH  12  17
ATOM     17  C   LIG    1        3.321   1.221  -1.405  0.00  0.00    +0.171 C 
BRANCH  17  18
ATOM     18  C   LIG    1        4.433   0.426  -0.728  0.00  0.00    +0.182 C 
BRANCH  18  20
ATOM     19  C   LIG    1        4.792  -1.505  -2.077  0.00  0.00    +0.194 C 
ATOM     20  O   LIG    1        4.242  -0.986  -0.872  0.00  0.00    -0.381 OA
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH  12  17
ENDBRANCH   1  15
BRANCH   2  21
ATOM     21  C   LIG    1       -2.724   1.458  -0.652  0.00  0.00    +0.020 C 
ATOM     22  C   LIG    1       -1.841   1.775  -1.864  0.00  0.00    +0.012 C 
ATOM     23  C   LIG    1       -2.985   2.719   0.175  0.00  0.00    +0.012 C 
ENDBRANCH   2  21
BRANCH   7  24
ATOM     24  C   LIG    1       -0.760  -3.873   3.148  0.00  0.00    +0.104 C 
ATOM     25  N   LIG    1        0.126  -4.466   3.605  0.00  0.00    -0.191 NA
ENDBRANCH   7  24
TORSDOF 6