REMARK  Name = BDB054480
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.617   0.307  -0.523  0.00  0.00    +0.221 A 
ATOM      2  N   LIG    1       -0.324  -0.014  -0.324  0.00  0.00    -0.195 NA
ATOM      3  C   LIG    1        0.532   0.820  -0.938  0.00  0.00    +0.164 A 
ATOM      4  C   LIG    1        0.200   1.916  -1.707  0.00  0.00    +0.057 A 
ATOM      5  C   LIG    1        1.431   2.458  -2.116  0.00  0.00    +0.146 A 
ATOM      6  N   LIG    1        2.478   1.769  -1.648  0.00  0.00    -0.177 NA
ATOM      7  C   LIG    1       -1.151   2.173  -1.859  0.00  0.00    +0.127 A 
ATOM      8  N   LIG    1        1.903   0.768  -0.933  0.00  0.00    -0.243 N 
ATOM      9  N   LIG    1       -2.049   1.356  -1.259  0.00  0.00    -0.222 NA
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1        2.730  -0.217  -0.241  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1        3.762  -0.881  -1.175  0.00  0.00    +0.027 C 
ATOM     12  C   LIG    1        5.158  -0.289  -1.000  0.00  0.00    +0.009 C 
ATOM     13  C   LIG    1        5.642  -0.456   0.429  0.00  0.00    -0.029 C 
ATOM     14  C   LIG    1        6.829  -1.363   0.685  0.00  0.00    +0.007 C 
ATOM     15  C   LIG    1        7.000   0.124   0.768  0.00  0.00    +0.007 C 
ATOM     16  C   LIG    1        4.559  -0.419   1.492  0.00  0.00    +0.009 C 
ATOM     17  C   LIG    1        3.360   0.396   1.022  0.00  0.00    +0.027 C 
ENDBRANCH   8  10
BRANCH   1  18
ATOM     18  N   LIG    1       -2.524  -0.551   0.107  0.00  0.00    -0.282 N 
ATOM     19  H   LIG    1       -1.983  -1.253   0.595  0.00  0.00    +0.155 HD
BRANCH  18  24
ATOM     20  C   LIG    1       -6.990  -2.026   1.253  0.00  0.00    +0.149 C 
ATOM     21  N   LIG    1       -5.922  -1.240   0.670  0.00  0.00    -0.344 N 
ATOM     22  C   LIG    1       -6.085  -0.118  -0.126  0.00  0.00    +0.106 A 
ATOM     23  C   LIG    1       -4.798   0.300  -0.455  0.00  0.00    +0.055 A 
ATOM     24  C   LIG    1       -3.868  -0.572   0.150  0.00  0.00    +0.052 A 
ATOM     25  C   LIG    1       -4.588  -1.515   0.840  0.00  0.00    +0.109 A 
BRANCH  22  26
ATOM     26  C   LIG    1       -7.367   0.444  -0.500  0.00  0.00    +0.258 C 
ATOM     27  O   LIG    1       -8.457  -0.020  -0.178  0.00  0.00    -0.269 OA
ATOM     28  N   LIG    1       -7.328   1.575  -1.261  0.00  0.00    -0.324 N 
ATOM     29  H   LIG    1       -8.209   2.002  -1.506  0.00  0.00    +0.145 HD
ATOM     30  H   LIG    1       -6.470   2.038  -1.515  0.00  0.00    +0.145 HD
ENDBRANCH  22  26
ENDBRANCH  18  24
ENDBRANCH   1  18
TORSDOF 4