REMARK  Name = BDB061790
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.767   0.205  -0.013  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.641   1.506   0.463  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -0.398   2.275   0.108  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.601   2.035   1.319  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.713   1.268   1.679  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        2.885  -0.029   1.167  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1        1.892  -0.559   0.327  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  13
ATOM      8  C   LIG    1       -3.980  -0.679  -1.284  0.00  0.00    +0.074 C 
ATOM      9  N   LIG    1       -4.300  -0.253   0.105  0.00  0.00    -0.296 NA
ATOM     10  C   LIG    1       -3.424  -0.885   1.090  0.00  0.00    +0.103 C 
ATOM     11  C   LIG    1       -1.972  -0.425   0.861  0.00  0.00    +0.123 C 
ATOM     12  N   LIG    1       -1.544  -0.504  -0.539  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1       -0.218  -0.373  -0.942  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1        0.205  -0.766  -2.029  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1       -2.488  -1.119  -1.468  0.00  0.00    +0.127 C 
BRANCH   8  17
ATOM     16  C   LIG    1       -4.611  -2.151  -3.305  0.00  0.00    +0.005 C 
ATOM     17  C   LIG    1       -4.906  -1.788  -1.853  0.00  0.00    +0.017 C 
ENDBRANCH   8  17
BRANCH   9  18
ATOM     18  C   LIG    1       -5.699  -0.216   0.510  0.00  0.00    +0.088 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -6.425   0.875  -0.229  0.00  0.00    +0.003 C 
ATOM     20  C   LIG    1       -6.204   2.322   0.134  0.00  0.00    +0.005 C 
ATOM     21  C   LIG    1       -7.517   1.663   0.453  0.00  0.00    +0.005 C 
ENDBRANCH  18  19
ENDBRANCH   9  18
ENDBRANCH   1  13
BRANCH   6  22
ATOM     22  C   LIG    1        4.095  -0.867   1.534  0.00  0.00    +0.162 C 
BRANCH  22  23
ATOM     23  N   LIG    1        5.373  -0.181   1.332  0.00  0.00    -0.289 N 
ATOM     24  C   LIG    1        5.934  -0.028   0.026  0.00  0.00    +0.059 A 
ATOM     25  C   LIG    1        7.151   0.648  -0.127  0.00  0.00    +0.063 A 
ATOM     26  C   LIG    1        7.739   0.828  -1.387  0.00  0.00    +0.015 A 
ATOM     27  C   LIG    1        7.109   0.328  -2.522  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1        5.900  -0.349  -2.393  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        7.828   1.182   1.064  0.00  0.00    +0.262 A 
ATOM     30  O   LIG    1        8.889   1.791   0.991  0.00  0.00    -0.267 OA
ATOM     31  N   LIG    1        7.203   0.959   2.258  0.00  0.00    -0.274 N 
ATOM     32  H   LIG    1        7.653   1.330   3.080  0.00  0.00    +0.173 HD
ATOM     33  C   LIG    1        5.319  -0.527  -1.131  0.00  0.00    +0.027 A 
ATOM     34  C   LIG    1        6.009   0.328   2.455  0.00  0.00    +0.330 A 
ATOM     35  O   LIG    1        5.557   0.250   3.597  0.00  0.00    -0.246 OA
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 6