REMARK  Name = BDB058148
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.791   0.274  -2.303  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -4.244   0.431  -0.878  0.00  0.00    -0.024 A 
ATOM      3  C   LIG    1       -3.312   0.401   0.174  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1       -3.776   0.549   1.486  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1       -2.781   0.517   2.569  0.00  0.00    +0.259 A 
ATOM      6  N   LIG    1       -1.483   0.309   2.179  0.00  0.00    -0.306 N 
ATOM      7  H   LIG    1       -0.809   0.339   2.927  0.00  0.00    +0.170 HD
ATOM      8  C   LIG    1       -1.099   0.175   0.864  0.00  0.00    +0.141 A 
ATOM      9  O   LIG    1       -3.084   0.675   3.746  0.00  0.00    -0.267 OA
ATOM     10  C   LIG    1       -5.133   0.727   1.770  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1       -6.051   0.756   0.724  0.00  0.00    +0.001 A 
ATOM     12  N   LIG    1       -1.945   0.224  -0.115  0.00  0.00    -0.229 NA
ATOM     13  C   LIG    1       -5.609   0.609  -0.593  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   8  14
ATOM     14  C   LIG    1        0.354  -0.012   0.602  0.00  0.00    +0.017 A 
ATOM     15  C   LIG    1        0.877   0.416  -0.622  0.00  0.00    +0.012 A 
ATOM     16  C   LIG    1        2.238   0.260  -0.910  0.00  0.00    +0.007 A 
ATOM     17  C   LIG    1        3.109  -0.330   0.018  0.00  0.00    -0.017 A 
ATOM     18  C   LIG    1        2.562  -0.777   1.237  0.00  0.00    +0.007 A 
ATOM     19  C   LIG    1        1.202  -0.623   1.530  0.00  0.00    +0.012 A 
BRANCH  17  20
ATOM     20  C   LIG    1        4.598  -0.534  -0.258  0.00  0.00    +0.085 C 
ATOM     21  C   LIG    1        5.171   0.338  -1.383  0.00  0.00    +0.046 C 
ATOM     22  C   LIG    1        4.888  -2.008  -0.557  0.00  0.00    +0.046 C 
BRANCH  20  23
ATOM     23  O   LIG    1        5.330  -0.182   0.925  0.00  0.00    -0.385 OA
ATOM     24  H   LIG    1        4.976   0.670   1.234  0.00  0.00    +0.211 HD
ENDBRANCH  20  23
ENDBRANCH  17  20
ENDBRANCH   8  14
TORSDOF 3