REMARK  Name = BDB002977
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.364  -0.625   0.273  0.00  0.00    +0.045 A 
ATOM      2  C   LIG    1        2.324  -1.665   0.353  0.00  0.00    +0.075 A 
ATOM      3  C   LIG    1        3.672  -1.441   0.025  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1        4.086  -0.164  -0.362  0.00  0.00    +0.128 A 
ATOM      5  C   LIG    1        3.169   0.887  -0.415  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1        1.828   0.653  -0.087  0.00  0.00    +0.026 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        5.494   0.077  -0.702  0.00  0.00    +0.056 N 
ATOM      8  O   LIG    1        5.821   1.228  -1.021  0.00  0.00    -0.126 OA
ATOM      9  O   LIG    1        6.270  -0.887  -0.650  0.00  0.00    -0.126 OA
ENDBRANCH   4   7
BRANCH   1  10
ATOM     10  N   LIG    1        0.038  -0.848   0.678  0.00  0.00    -0.341 N 
ATOM     11  H   LIG    1       -0.269  -1.805   0.494  0.00  0.00    +0.146 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -1.012   0.130   0.370  0.00  0.00    +0.120 C 
BRANCH  12  13
ATOM     13  C   LIG    1       -2.373  -0.370   0.888  0.00  0.00    +0.122 C 
BRANCH  13  16
ATOM     14  C   LIG    1       -5.122   1.897  -0.410  0.00  0.00    +0.109 C 
ATOM     15  C   LIG    1       -3.949   0.957  -0.467  0.00  0.00    +0.210 C 
ATOM     16  N   LIG    1       -3.440   0.607   0.762  0.00  0.00    -0.314 N 
ATOM     17  H   LIG    1       -3.947   0.869   1.597  0.00  0.00    +0.149 HD
ATOM     18  O   LIG    1       -3.493   0.542  -1.527  0.00  0.00    -0.276 OA
ENDBRANCH  13  16
ENDBRANCH  12  13
ENDBRANCH  10  12
ENDBRANCH   1  10
BRANCH   2  19
ATOM     19  C   LIG    1        1.948  -2.988   0.767  0.00  0.00    +0.101 C 
ATOM     20  N   LIG    1        1.637  -4.061   1.085  0.00  0.00    -0.191 NA
ENDBRANCH   2  19
TORSDOF 6