REMARK  Name = BDB056155
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.687  -1.856  -0.421  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1       -0.055  -0.745   0.335  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1        1.096  -1.192   1.264  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1        2.182  -1.865   0.518  0.00  0.00    -0.327 N 
ATOM      5  C   LIG    1        1.768  -2.460  -0.773  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1        0.296  -2.926  -0.713  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.416  -1.204   0.427  0.00  0.00    +0.033 A 
ATOM      8  C   LIG    1        4.615  -1.923   0.624  0.00  0.00    -0.029 A 
ATOM      9  C   LIG    1        4.607  -3.388   0.970  0.00  0.00    +0.045 C 
ATOM     10  C   LIG    1        5.855  -1.274   0.474  0.00  0.00    +0.018 A 
ATOM     11  C   LIG    1        5.920   0.088   0.167  0.00  0.00    +0.037 A 
ATOM     12  C   LIG    1        4.738   0.805  -0.028  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1        3.503   0.161   0.101  0.00  0.00    +0.024 A 
BRANCH  11  14
ATOM     14  C   LIG    1        7.259   0.724   0.028  0.00  0.00    +0.244 C 
ATOM     15  N   LIG    1        7.330   2.068   0.338  0.00  0.00    -0.314 N 
ATOM     16  H   LIG    1        6.571   2.479   0.864  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        8.602   2.744   0.359  0.00  0.00    +0.128 C 
ATOM     18  O   LIG    1        8.228   0.056  -0.313  0.00  0.00    -0.270 OA
ENDBRANCH  11  14
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1       -1.337  -1.375  -1.650  0.00  0.00    +0.119 C 
BRANCH  19  31
ATOM     20  C   LIG    1       -4.659   0.005  -0.342  0.00  0.00    +0.164 A 
ATOM     21  C   LIG    1       -4.650   1.298  -0.889  0.00  0.00    +0.184 A 
ATOM     22  O   LIG    1       -5.744   2.092  -0.652  0.00  0.00    -0.474 OA
ATOM     23  C   LIG    1       -5.581   3.476  -0.938  0.00  0.00    +0.256 C 
ATOM     24  C   LIG    1       -4.560   3.892  -2.003  0.00  0.00    +0.258 C 
ATOM     25  N   LIG    1       -3.570   2.985  -2.254  0.00  0.00    -0.279 N 
ATOM     26  H   LIG    1       -2.849   3.268  -2.904  0.00  0.00    +0.155 HD
ATOM     27  O   LIG    1       -4.569   4.990  -2.557  0.00  0.00    -0.271 OA
ATOM     28  C   LIG    1       -5.263   4.199   0.368  0.00  0.00    +0.062 C 
ATOM     29  C   LIG    1       -3.575   1.714  -1.681  0.00  0.00    +0.080 A 
ATOM     30  C   LIG    1       -2.504   0.856  -1.933  0.00  0.00    +0.032 A 
ATOM     31  C   LIG    1       -2.493  -0.432  -1.383  0.00  0.00    -0.028 A 
ATOM     32  C   LIG    1       -3.579  -0.849  -0.592  0.00  0.00    +0.054 A 
BRANCH  20  33
ATOM     33  O   LIG    1       -5.754  -0.321   0.417  0.00  0.00    -0.489 OA
BRANCH  33  35
ATOM     34  C   LIG    1       -7.082  -1.737   1.796  0.00  0.00    +0.048 C 
ATOM     35  C   LIG    1       -5.791  -1.619   1.006  0.00  0.00    +0.226 C 
ENDBRANCH  33  35
ENDBRANCH  20  33
ENDBRANCH  19  31
ENDBRANCH   1  19
TORSDOF 6