REMARK  Name = BDB060380
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.114   1.004  -0.479  0.00  0.00    -0.252 OA
ATOM      2  C   LIG    1        0.938  -0.085   0.049  0.00  0.00    +0.308 C 
ATOM      3  N   LIG    1       -0.299  -0.634   0.356  0.00  0.00    -0.269 N 
ATOM      4  H   LIG    1       -0.304  -1.623   0.555  0.00  0.00    +0.156 HD
ATOM      5  N   LIG    1        1.953  -0.950   0.434  0.00  0.00    -0.269 N 
ATOM      6  H   LIG    1        1.692  -1.655   1.106  0.00  0.00    +0.156 HD
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -1.566  -0.028   0.221  0.00  0.00    +0.035 A 
ATOM      8  C   LIG    1       -2.683  -0.843   0.435  0.00  0.00    +0.035 A 
ATOM      9  C   LIG    1       -3.937  -0.269   0.316  0.00  0.00    +0.022 A 
ATOM     10  C   LIG    1       -5.237  -0.899   0.485  0.00  0.00    +0.164 C 
ATOM     11  C   LIG    1       -6.324   0.120   0.252  0.00  0.00    +0.084 C 
ATOM     12  C   LIG    1       -5.584   1.431  -0.067  0.00  0.00    +0.043 C 
ATOM     13  O   LIG    1       -5.391  -2.073   0.773  0.00  0.00    -0.292 OA
ATOM     14  C   LIG    1       -4.136   1.066   0.001  0.00  0.00    -0.036 A 
ATOM     15  C   LIG    1       -3.041   1.885  -0.205  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1       -1.756   1.332  -0.091  0.00  0.00    +0.023 A 
ENDBRANCH   3   7
BRANCH   5  17
ATOM     17  C   LIG    1        3.335  -0.809   0.184  0.00  0.00    +0.037 A 
ATOM     18  C   LIG    1        3.874   0.119  -0.710  0.00  0.00    +0.056 A 
ATOM     19  C   LIG    1        5.264   0.178  -0.895  0.00  0.00    +0.128 A 
ATOM     20  C   LIG    1        6.122  -0.684  -0.200  0.00  0.00    +0.033 A 
ATOM     21  C   LIG    1        5.581  -1.616   0.682  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1        4.197  -1.680   0.868  0.00  0.00    +0.023 A 
BRANCH  19  23
ATOM     23  N   LIG    1        5.832   1.151  -1.836  0.00  0.00    +0.056 N 
ATOM     24  O   LIG    1        5.061   1.720  -2.620  0.00  0.00    -0.126 OA
ATOM     25  O   LIG    1        7.057   1.339  -1.795  0.00  0.00    -0.126 OA
ENDBRANCH  19  23
ENDBRANCH   5  17
TORSDOF 3