REMARK  Name = BDB056278
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.476   0.540  -0.071  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.605   0.542   1.024  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1       -0.559  -0.226   0.986  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1       -0.862  -0.967  -0.164  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        0.009  -0.971  -1.259  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        1.174  -0.204  -1.220  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -2.074  -1.812  -0.213  0.00  0.00    +0.247 C 
ATOM      8  N   LIG    1       -3.324  -1.217  -0.007  0.00  0.00    -0.297 N 
ATOM      9  C   LIG    1       -3.576   0.197  -0.311  0.00  0.00    +0.113 C 
ATOM     10  C   LIG    1       -4.930   0.693   0.225  0.00  0.00    +0.024 C 
ATOM     11  C   LIG    1       -6.057  -0.189  -0.353  0.00  0.00    +0.066 C 
ATOM     12  C   LIG    1       -5.770  -1.469   0.459  0.00  0.00    +0.024 C 
ATOM     13  C   LIG    1       -5.585  -0.956   1.898  0.00  0.00    +0.007 C 
ATOM     14  C   LIG    1       -5.033   0.468   1.744  0.00  0.00    +0.007 C 
ATOM     15  C   LIG    1       -4.477  -2.113  -0.067  0.00  0.00    +0.113 C 
ATOM     16  O   LIG    1       -1.918  -3.011  -0.428  0.00  0.00    -0.270 OA
BRANCH  11  17
ATOM     17  N   LIG    1       -7.400   0.365  -0.091  0.00  0.00    -0.299 NA
ATOM     18  C   LIG    1       -8.483  -0.519  -0.538  0.00  0.00    +0.085 C 
ATOM     19  C   LIG    1       -9.705   0.386  -0.550  0.00  0.00    +0.017 C 
ATOM     20  C   LIG    1       -9.156   1.797  -0.703  0.00  0.00    +0.017 C 
ATOM     21  C   LIG    1       -7.648   1.628  -0.795  0.00  0.00    +0.085 C 
ENDBRANCH  11  17
ENDBRANCH   4   7
BRANCH   1  23
ATOM     22  O   LIG    1        2.546   2.573   0.247  0.00  0.00    -0.270 OA
ATOM     23  C   LIG    1        2.693   1.381  -0.013  0.00  0.00    +0.247 C 
ATOM     24  N   LIG    1        3.933   0.791  -0.257  0.00  0.00    -0.297 N 
ATOM     25  C   LIG    1        5.107   1.660  -0.277  0.00  0.00    +0.109 C 
ATOM     26  C   LIG    1        6.233   1.069  -1.116  0.00  0.00    +0.038 C 
ATOM     27  C   LIG    1        6.637  -0.351  -0.662  0.00  0.00    +0.060 C 
ATOM     28  C   LIG    1        5.581  -0.985   0.263  0.00  0.00    +0.038 C 
ATOM     29  C   LIG    1        4.172  -0.654  -0.217  0.00  0.00    +0.109 C 
BRANCH  27  30
ATOM     30  N   LIG    1        7.976  -0.502  -0.073  0.00  0.00    -0.299 NA
ATOM     31  C   LIG    1        8.285   0.348   1.075  0.00  0.00    +0.085 C 
ATOM     32  C   LIG    1        9.784   0.152   1.252  0.00  0.00    +0.017 C 
ATOM     33  C   LIG    1       10.300  -0.274  -0.118  0.00  0.00    +0.017 C 
ATOM     34  C   LIG    1        9.074  -0.302  -1.018  0.00  0.00    +0.085 C 
ENDBRANCH  27  30
ENDBRANCH   1  23
TORSDOF 4