REMARK  Name = BDB058094
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.472  -0.230  -0.205  0.00  0.00    +0.117 C 
ATOM      2  C   LIG    1       -1.926  -0.339  -0.769  0.00  0.00    +0.058 C 
ATOM      3  C   LIG    1       -2.850   0.873  -0.510  0.00  0.00    +0.032 C 
ATOM      4  C   LIG    1       -2.409   2.164  -1.211  0.00  0.00    +0.019 C 
ATOM      5  C   LIG    1       -4.263   0.509  -1.009  0.00  0.00    +0.019 C 
ATOM      6  C   LIG    1       -2.901   1.136   0.993  0.00  0.00    +0.179 C 
ATOM      7  O   LIG    1       -3.899   1.610   1.532  0.00  0.00    -0.291 OA
ATOM      8  C   LIG    1       -1.681   0.849   1.794  0.00  0.00    +0.094 C 
ATOM      9  C   LIG    1       -0.610   0.260   1.229  0.00  0.00    +0.034 C 
ENDROOT
BRANCH   1  10
ATOM     10  C   LIG    1        0.324  -1.559  -0.286  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1        1.621  -1.758   0.234  0.00  0.00    +0.080 A 
ATOM     12  N   LIG    1        2.284  -2.948   0.175  0.00  0.00    -0.254 NA
ATOM     13  C   LIG    1        1.694  -3.983  -0.444  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1        0.448  -3.900  -1.017  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -0.232  -2.686  -0.938  0.00  0.00    +0.010 A 
BRANCH  11  16
ATOM     16  C   LIG    1        2.418  -0.766   0.932  0.00  0.00    +0.038 A 
ATOM     17  C   LIG    1        2.918   0.408   0.412  0.00  0.00    +0.118 A 
ATOM     18  N   LIG    1        3.648   0.988   1.410  0.00  0.00    -0.274 N 
ATOM     19  C   LIG    1        4.346   2.249   1.356  0.00  0.00    +0.172 C 
ATOM     20  N   LIG    1        3.698   0.251   2.534  0.00  0.00    -0.179 NA
ATOM     21  C   LIG    1        2.990  -0.839   2.223  0.00  0.00    +0.144 A 
ENDBRANCH  11  16
ENDBRANCH   1  10
BRANCH   1  23
ATOM     22  C   LIG    1        0.531   0.613  -2.265  0.00  0.00    +0.195 C 
ATOM     23  O   LIG    1        0.232   0.819  -0.888  0.00  0.00    -0.368 OA
ENDBRANCH   1  23
BRANCH   8  24
ATOM     24  C   LIG    1       -1.661   1.241   3.163  0.00  0.00    +0.102 C 
ATOM     25  N   LIG    1       -1.598   1.537   4.284  0.00  0.00    -0.191 NA
ENDBRANCH   8  24
TORSDOF 4