REMARK  Name = BDB055744
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.241  -1.841   0.127  0.00  0.00    +0.057 A 
ATOM      2  C   LIG    1        1.358  -0.990   0.371  0.00  0.00    +0.051 A 
ATOM      3  C   LIG    1        2.591  -1.583   0.670  0.00  0.00    +0.027 A 
ATOM      4  C   LIG    1        2.729  -2.973   0.710  0.00  0.00    +0.034 A 
ATOM      5  C   LIG    1        1.622  -3.790   0.453  0.00  0.00    +0.128 A 
ATOM      6  C   LIG    1        0.373  -3.232   0.163  0.00  0.00    +0.058 A 
ENDROOT
BRANCH   2   7
ATOM      7  N   LIG    1        1.175   0.403   0.279  0.00  0.00    -0.326 N 
ATOM      8  C   LIG    1        1.834   1.284   1.269  0.00  0.00    +0.120 C 
ATOM      9  C   LIG    1        3.190   1.864   0.799  0.00  0.00    +0.103 C 
ATOM     10  N   LIG    1        3.150   2.432  -0.563  0.00  0.00    -0.302 NA
ATOM     11  C   LIG    1        4.474   2.895  -0.973  0.00  0.00    +0.105 C 
ATOM     12  C   LIG    1        2.637   1.414  -1.503  0.00  0.00    +0.103 C 
ATOM     13  C   LIG    1        1.226   0.929  -1.109  0.00  0.00    +0.120 C 
ENDBRANCH   2   7
BRANCH   1  15
ATOM     14  C   LIG    1       -2.201  -1.726  -0.453  0.00  0.00    +0.248 C 
ATOM     15  N   LIG    1       -0.988  -1.183  -0.095  0.00  0.00    -0.280 N 
ATOM     16  H   LIG    1       -0.897  -0.174  -0.016  0.00  0.00    +0.155 HD
ATOM     17  O   LIG    1       -2.417  -2.898  -0.732  0.00  0.00    -0.270 OA
BRANCH  14  20
ATOM     18  C   LIG    1       -4.470   1.259   0.186  0.00  0.00    +0.121 A 
ATOM     19  C   LIG    1       -3.408   0.362   0.311  0.00  0.00    +0.058 A 
ATOM     20  C   LIG    1       -3.324  -0.748  -0.546  0.00  0.00    +0.040 A 
ATOM     21  C   LIG    1       -4.320  -0.972  -1.503  0.00  0.00    +0.013 A 
ATOM     22  C   LIG    1       -5.380  -0.076  -1.627  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -5.448   1.036  -0.788  0.00  0.00    +0.045 A 
BRANCH  18  25
ATOM     24  C   LIG    1       -3.727   2.640   1.978  0.00  0.00    +0.277 C 
ATOM     25  O   LIG    1       -4.670   2.379   0.946  0.00  0.00    -0.495 OA
ENDBRANCH  18  25
ENDBRANCH  14  20
ENDBRANCH   1  15
BRANCH   5  26
ATOM     26  N   LIG    1        1.778  -5.249   0.499  0.00  0.00    +0.056 N 
ATOM     27  O   LIG    1        0.757  -5.947   0.440  0.00  0.00    -0.126 OA
ATOM     28  O   LIG    1        2.930  -5.698   0.600  0.00  0.00    -0.126 OA
ENDBRANCH   5  26
TORSDOF 5