REMARK  Name = BDB011656
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.092  -0.629   0.450  0.00  0.00    +0.270 C 
ATOM      2  N   LIG    1       -0.029  -0.453  -0.331  0.00  0.00    -0.274 N 
ATOM      3  H   LIG    1        0.159  -0.331  -1.329  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        1.092  -0.846   1.656  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.356  -0.499  -0.009  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1       -2.367  -0.412  -1.107  0.00  0.00    +0.289 A 
ATOM      7  O   LIG    1       -2.078  -0.198  -2.274  0.00  0.00    -0.264 OA
ATOM      8  N   LIG    1       -3.630  -0.553  -0.533  0.00  0.00    -0.245 N 
ATOM      9  N   LIG    1       -3.463  -0.630   0.881  0.00  0.00    -0.287 N 
ATOM     10  C   LIG    1       -4.282  -1.661   1.526  0.00  0.00    +0.170 C 
ATOM     11  C   LIG    1       -2.075  -0.592   1.123  0.00  0.00    +0.059 A 
ATOM     12  C   LIG    1       -1.577  -0.594   2.533  0.00  0.00    +0.067 C 
BRANCH   8  13
ATOM     13  C   LIG    1       -4.787   0.126  -1.117  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1       -5.369   1.238  -0.228  0.00  0.00    +0.027 C 
ATOM     15  C   LIG    1       -6.548   1.933  -0.908  0.00  0.00    +0.002 C 
ATOM     16  C   LIG    1       -7.620   0.933  -1.332  0.00  0.00    +0.000 C 
ATOM     17  C   LIG    1       -7.047  -0.171  -2.215  0.00  0.00    +0.002 C 
ATOM     18  C   LIG    1       -5.867  -0.876  -1.547  0.00  0.00    +0.027 C 
ENDBRANCH   8  13
ENDBRANCH   2   5
BRANCH   1  22
ATOM     19  C   LIG    1        4.458  -0.493  -1.013  0.00  0.00    +0.170 A 
ATOM     20  C   LIG    1        3.700  -0.659   0.137  0.00  0.00    +0.026 A 
ATOM     21  C   LIG    1        4.141  -0.867   1.538  0.00  0.00    +0.050 C 
ATOM     22  C   LIG    1        2.345  -0.554  -0.324  0.00  0.00    +0.171 A 
ATOM     23  N   LIG    1        2.309  -0.374  -1.654  0.00  0.00    -0.073 NA
ATOM     24  O   LIG    1        3.614  -0.337  -2.073  0.00  0.00    -0.356 OA
BRANCH  19  29
ATOM     25  C   LIG    1        7.547   2.081   1.699  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1        7.113   1.145   0.610  0.00  0.00    -0.051 C 
ATOM     27  C   LIG    1        6.345   1.770  -0.529  0.00  0.00    +0.191 C 
ATOM     28  O   LIG    1        6.263   0.926  -1.681  0.00  0.00    -0.364 OA
ATOM     29  C   LIG    1        5.904  -0.434  -1.398  0.00  0.00    +0.191 C 
ATOM     30  C   LIG    1        6.919  -1.087  -0.455  0.00  0.00    +0.067 C 
ATOM     31  C   LIG    1        7.390  -0.170   0.638  0.00  0.00    -0.023 C 
ENDBRANCH  19  29
ENDBRANCH   1  22
TORSDOF 4