REMARK  Name = BDB034161
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.789   1.038   0.332  0.00  0.00    +0.019 A 
ATOM      2  C   LIG    1       -4.885   1.126   1.528  0.00  0.00    +0.252 A 
ATOM      3  O   LIG    1       -5.197   1.761   2.530  0.00  0.00    -0.268 OA
ATOM      4  N   LIG    1       -3.687   0.464   1.455  0.00  0.00    -0.321 N 
ATOM      5  H   LIG    1       -3.089   0.533   2.266  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -3.280  -0.262   0.329  0.00  0.00    +0.068 A 
ATOM      7  C   LIG    1       -4.109  -0.336  -0.788  0.00  0.00    +0.088 A 
ATOM      8  N   LIG    1       -3.795  -1.012  -1.913  0.00  0.00    -0.253 NA
ATOM      9  C   LIG    1       -2.594  -1.638  -1.918  0.00  0.00    +0.116 A 
ATOM     10  C   LIG    1       -1.689  -1.619  -0.857  0.00  0.00    -0.013 A 
ATOM     11  C   LIG    1       -2.056  -0.916   0.298  0.00  0.00    +0.034 A 
ATOM     12  C   LIG    1       -5.395   0.351  -0.756  0.00  0.00    +0.038 A 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1       -8.137   1.021   1.226  0.00  0.00    +0.009 C 
ATOM     14  C   LIG    1       -7.099   1.772   0.404  0.00  0.00    +0.037 C 
ENDBRANCH   1  14
BRANCH  10  15
ATOM     15  C   LIG    1       -0.380  -2.366  -0.942  0.00  0.00    +0.121 C 
BRANCH  15  16
ATOM     16  N   LIG    1        0.785  -1.545  -0.578  0.00  0.00    -0.294 NA
ATOM     17  C   LIG    1        1.983  -2.385  -0.428  0.00  0.00    +0.090 C 
ATOM     18  C   LIG    1        3.148  -1.552   0.127  0.00  0.00    +0.054 C 
ATOM     19  C   LIG    1        3.359  -0.261  -0.634  0.00  0.00    -0.006 C 
ATOM     20  C   LIG    1        2.367   0.181  -1.433  0.00  0.00    -0.005 C 
ATOM     21  C   LIG    1        1.036  -0.496  -1.585  0.00  0.00    +0.112 C 
BRANCH  19  22
ATOM     22  C   LIG    1        4.580   0.481  -0.673  0.00  0.00    +0.136 A 
ATOM     23  N   LIG    1        5.219   0.893   0.483  0.00  0.00    -0.331 N 
ATOM     24  C   LIG    1        4.735   0.748   1.837  0.00  0.00    +0.150 C 
ATOM     25  C   LIG    1        6.388   1.528   0.115  0.00  0.00    +0.035 A 
ATOM     26  C   LIG    1        7.384   2.086   1.059  0.00  0.00    +0.065 C 
ATOM     27  C   LIG    1        6.370   1.517  -1.261  0.00  0.00    +0.134 A 
ATOM     28  N   LIG    1        5.254   0.887  -1.733  0.00  0.00    -0.236 NA
ENDBRANCH  19  22
ENDBRANCH  15  16
ENDBRANCH  10  15
TORSDOF 4