REMARK  Name = BDB056276
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.364  -0.323  -1.157  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.362  -1.413  -0.280  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1        0.781  -1.696   0.471  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1        1.931  -0.908   0.325  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        1.927   0.180  -0.557  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        0.784   0.464  -1.309  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1       -1.383   0.109  -3.197  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -1.552  -0.013  -1.986  0.00  0.00    +0.247 C 
ATOM      9  N   LIG    1       -2.793   0.121  -1.369  0.00  0.00    -0.297 N 
ATOM     10  C   LIG    1       -3.965   0.282  -2.224  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1       -5.244  -0.074  -1.480  0.00  0.00    +0.038 C 
ATOM     12  C   LIG    1       -5.476   0.842  -0.254  0.00  0.00    +0.060 C 
ATOM     13  C   LIG    1       -4.123   1.318   0.329  0.00  0.00    +0.038 C 
ATOM     14  C   LIG    1       -2.994   0.329   0.069  0.00  0.00    +0.109 C 
BRANCH  12  15
ATOM     15  N   LIG    1       -6.332   0.168   0.749  0.00  0.00    -0.299 NA
ATOM     16  C   LIG    1       -6.715   1.034   1.873  0.00  0.00    +0.085 C 
ATOM     17  C   LIG    1       -7.922   0.345   2.498  0.00  0.00    +0.017 C 
ATOM     18  C   LIG    1       -8.418  -0.632   1.444  0.00  0.00    +0.017 C 
ATOM     19  C   LIG    1       -7.615  -0.295   0.201  0.00  0.00    +0.085 C 
ENDBRANCH  12  15
ENDBRANCH   1   8
BRANCH   4  20
ATOM     20  C   LIG    1        3.120  -1.234   1.153  0.00  0.00    +0.247 C 
ATOM     21  N   LIG    1        4.363  -1.067   0.581  0.00  0.00    -0.294 N 
ATOM     22  C   LIG    1        4.759  -1.366  -0.802  0.00  0.00    +0.128 C 
ATOM     23  C   LIG    1        6.190  -1.577  -0.274  0.00  0.00    +0.091 C 
ATOM     24  C   LIG    1        5.606  -1.606   1.147  0.00  0.00    +0.128 C 
ATOM     25  O   LIG    1        2.959  -1.634   2.303  0.00  0.00    -0.270 OA
BRANCH  23  26
ATOM     26  N   LIG    1        7.060  -0.423  -0.585  0.00  0.00    -0.296 NA
ATOM     27  C   LIG    1        8.408  -0.615  -0.046  0.00  0.00    +0.085 C 
ATOM     28  C   LIG    1        9.040   0.769  -0.134  0.00  0.00    +0.017 C 
ATOM     29  C   LIG    1        7.883   1.728  -0.385  0.00  0.00    +0.017 C 
ATOM     30  C   LIG    1        6.634   0.900  -0.128  0.00  0.00    +0.085 C 
ENDBRANCH  23  26
ENDBRANCH   4  20
TORSDOF 4