REMARK  Name = BDB001063
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.042  -1.843  -1.014  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.513  -2.634   0.029  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.823  -2.882   0.172  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.374  -3.193   0.942  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.746  -2.971   0.805  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -2.243  -2.191  -0.252  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -1.337  -1.644  -1.173  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        0.725  -1.495  -3.196  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        0.955  -1.254  -2.011  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1        1.991  -0.429  -1.593  0.00  0.00    -0.295 N 
ATOM     11  C   LIG    1        2.918   0.086  -2.600  0.00  0.00    +0.123 C 
ATOM     12  C   LIG    1        4.265   0.494  -1.977  0.00  0.00    +0.103 C 
ATOM     13  N   LIG    1        4.154   1.538  -0.927  0.00  0.00    -0.297 NA
ATOM     14  C   LIG    1        2.845   1.484  -0.239  0.00  0.00    +0.103 C 
ATOM     15  C   LIG    1        2.157   0.105  -0.236  0.00  0.00    +0.123 C 
BRANCH  13  16
ATOM     16  C   LIG    1        5.274   1.458   0.038  0.00  0.00    +0.112 C 
BRANCH  16  17
ATOM     17  C   LIG    1        6.627   1.781  -0.616  0.00  0.00    +0.171 C 
BRANCH  17  18
ATOM     18  O   LIG    1        6.547   3.029  -1.301  0.00  0.00    -0.394 OA
ATOM     19  H   LIG    1        5.633   3.068  -1.650  0.00  0.00    +0.209 HD
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH  13  16
ENDBRANCH   1   9
BRANCH   6  20
ATOM     20  C   LIG    1       -3.731  -1.978  -0.415  0.00  0.00    +0.093 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -4.371  -1.319   0.801  0.00  0.00    +0.074 A 
ATOM     22  C   LIG    1       -4.290   0.154   0.982  0.00  0.00    +0.011 A 
ATOM     23  C   LIG    1       -4.867   0.684   2.135  0.00  0.00    +0.050 A 
ATOM     24  C   LIG    1       -4.829   2.062   2.385  0.00  0.00    +0.014 A 
ATOM     25  C   LIG    1       -4.210   2.915   1.473  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -3.634   2.392   0.316  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -5.525  -0.219   3.091  0.00  0.00    +0.272 A 
ATOM     28  O   LIG    1       -6.043   0.203   4.119  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -5.524  -1.552   2.762  0.00  0.00    -0.242 N 
ATOM     30  H   LIG    1       -5.977  -2.190   3.409  0.00  0.00    +0.192 HD
ATOM     31  C   LIG    1       -3.673   1.016   0.068  0.00  0.00    +0.010 A 
ATOM     32  N   LIG    1       -4.960  -2.104   1.655  0.00  0.00    -0.175 NA
ENDBRANCH  20  21
ENDBRANCH   6  20
TORSDOF 6