REMARK  Name = BDB057881
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.837  -0.202  -0.096  0.00  0.00    +0.062 A 
ATOM      2  C   LIG    1       -0.542  -0.714  -0.056  0.00  0.00    +0.045 A 
ATOM      3  C   LIG    1        0.496   0.166   0.208  0.00  0.00    +0.093 A 
ATOM      4  N   LIG    1        0.294   1.495   0.414  0.00  0.00    -0.253 NA
ATOM      5  C   LIG    1       -0.971   1.961   0.340  0.00  0.00    +0.112 A 
ATOM      6  C   LIG    1       -2.067   1.160   0.090  0.00  0.00    +0.035 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1        1.866  -0.306   0.283  0.00  0.00    +0.130 A 
ATOM      8  N   LIG    1        2.245  -1.621   0.169  0.00  0.00    -0.128 NA
ATOM      9  N   LIG    1        3.565  -1.683   0.291  0.00  0.00    -0.068 NA
ATOM     10  N   LIG    1        4.011  -0.431   0.475  0.00  0.00    -0.264 N 
ATOM     11  H   LIG    1        5.007  -0.279   0.586  0.00  0.00    +0.190 HD
ATOM     12  C   LIG    1        2.988   0.467   0.482  0.00  0.00    +0.136 A 
ENDBRANCH   3   7
BRANCH   1  14
ATOM     13  O   LIG    1       -2.906  -1.972  -1.256  0.00  0.00    -0.245 OA
ATOM     14  C   LIG    1       -2.952  -1.124  -0.384  0.00  0.00    +0.337 C 
BRANCH  14  15
ATOM     15  O   LIG    1       -4.005  -0.943   0.440  0.00  0.00    -0.477 OA
ATOM     16  H   LIG    1       -3.836  -0.359   1.203  0.00  0.00    +0.295 HD
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 3