REMARK  Name = BDB023107
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.165  -3.049   0.623  0.00  0.00    +0.159 A 
ATOM      2  N   LIG    1        2.978  -1.960   0.428  0.00  0.00    -0.217 NA
ATOM      3  C   LIG    1        2.227  -1.068  -0.194  0.00  0.00    +0.151 A 
ATOM      4  N   LIG    1        0.942  -1.541  -0.378  0.00  0.00    -0.270 N 
ATOM      5  C   LIG    1       -0.062  -0.788  -1.010  0.00  0.00    +0.202 A 
ATOM      6  N   LIG    1        0.219   0.389  -1.496  0.00  0.00    -0.223 NA
ATOM      7  C   LIG    1        1.497   0.874  -1.311  0.00  0.00    +0.126 A 
ATOM      8  C   LIG    1        2.517   0.243  -0.685  0.00  0.00    +0.048 A 
ATOM      9  C   LIG    1        0.905  -2.822   0.123  0.00  0.00    +0.134 A 
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1        3.827   0.884  -0.545  0.00  0.00    +0.051 A 
ATOM     11  C   LIG    1        3.930   2.319  -0.082  0.00  0.00    +0.257 A 
ATOM     12  O   LIG    1        2.947   3.002   0.193  0.00  0.00    -0.267 OA
ATOM     13  N   LIG    1        5.200   2.841   0.023  0.00  0.00    -0.329 N 
ATOM     14  H   LIG    1        5.253   3.803   0.335  0.00  0.00    +0.168 HD
ATOM     15  C   LIG    1        6.345   2.138  -0.237  0.00  0.00    +0.086 A 
ATOM     16  C   LIG    1        6.272   0.862  -0.628  0.00  0.00    +0.018 A 
ATOM     17  C   LIG    1        4.983   0.229  -0.778  0.00  0.00    +0.015 A 
ENDBRANCH   8  10
BRANCH   1  19
ATOM     18  N   LIG    1        2.999  -5.220   1.768  0.00  0.00    -0.189 NA
ATOM     19  C   LIG    1        2.643  -4.240   1.257  0.00  0.00    +0.121 C 
ENDBRANCH   1  19
BRANCH   5  20
ATOM     20  N   LIG    1       -1.343  -1.278  -1.143  0.00  0.00    -0.310 N 
ATOM     21  H   LIG    1       -1.856  -0.657  -1.768  0.00  0.00    +0.149 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -2.142  -1.569   0.045  0.00  0.00    +0.143 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.498  -0.932  -0.048  0.00  0.00    +0.012 A 
ATOM     24  C   LIG    1       -3.686   0.445   0.051  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1       -2.699   1.544   0.188  0.00  0.00    +0.080 C 
ATOM     26  C   LIG    1       -3.647   2.688   0.546  0.00  0.00    +0.234 C 
ATOM     27  O   LIG    1       -4.971   2.368   0.057  0.00  0.00    -0.491 OA
ATOM     28  C   LIG    1       -4.956   1.002  -0.051  0.00  0.00    +0.124 A 
ATOM     29  C   LIG    1       -6.084   0.235  -0.259  0.00  0.00    +0.049 A 
ATOM     30  C   LIG    1       -5.921  -1.146  -0.353  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1       -4.644  -1.714  -0.247  0.00  0.00    +0.129 A 
ATOM     32  F   LIG    1       -4.529  -3.046  -0.343  0.00  0.00    -0.205 F 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   5  20
TORSDOF 5