REMARK  Name = BDB028771
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -2.803   3.053  -1.540  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1       -2.350   1.988  -1.127  0.00  0.00    +0.222 C 
ATOM      3  N   LIG    1       -2.206   0.909  -1.957  0.00  0.00    -0.240 N 
ATOM      4  H   LIG    1       -2.394   1.085  -2.933  0.00  0.00    +0.159 HD
ATOM      5  C   LIG    1       -1.437  -0.193  -1.693  0.00  0.00    +0.309 C 
ATOM      6  O   LIG    1       -0.979  -0.870  -2.607  0.00  0.00    -0.252 OA
ATOM      7  N   LIG    1       -1.207  -0.439  -0.360  0.00  0.00    -0.279 N 
ATOM      8  C   LIG    1       -1.860   0.363   0.658  0.00  0.00    +0.119 C 
ATOM      9  C   LIG    1       -1.830   1.826   0.275  0.00  0.00    +0.115 C 
ENDROOT
BRANCH   7  10
ATOM     10  C   LIG    1       -0.405  -1.586   0.054  0.00  0.00    +0.164 C 
BRANCH  10  11
ATOM     11  C   LIG    1        0.993  -1.175   0.464  0.00  0.00    +0.059 A 
ATOM     12  N   LIG    1        1.230  -1.003   1.791  0.00  0.00    -0.258 NA
ATOM     13  C   LIG    1        2.472  -0.609   2.151  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1        3.496  -0.365   1.251  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        3.234  -0.533  -0.103  0.00  0.00    +0.003 A 
ATOM     16  C   LIG    1        1.966  -0.941  -0.506  0.00  0.00    +0.025 A 
ENDBRANCH  10  11
ENDBRANCH   7  10
TORSDOF 2