REMARK  Name = BDB051087
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.302  -1.784  -0.273  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.122  -2.364  -1.525  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.151  -2.531  -2.368  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        1.136  -2.810  -1.919  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        2.223  -2.686  -1.050  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        2.058  -2.119   0.224  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        0.781  -1.687   0.612  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1       -1.999  -1.640   1.308  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -1.624  -1.313   0.185  0.00  0.00    +0.250 C 
ATOM     10  N   LIG    1       -2.340  -0.489  -0.651  0.00  0.00    -0.292 N 
ATOM     11  C   LIG    1       -3.532   0.312  -0.344  0.00  0.00    +0.039 C 
ATOM     12  C   LIG    1       -4.776  -0.564  -0.204  0.00  0.00    +0.026 C 
ATOM     13  C   LIG    1       -6.007   0.323  -0.018  0.00  0.00    +0.002 C 
ATOM     14  C   LIG    1       -5.838   1.272   1.169  0.00  0.00    +0.000 C 
ATOM     15  C   LIG    1       -4.570   2.116   1.042  0.00  0.00    +0.002 C 
ATOM     16  C   LIG    1       -3.330   1.240   0.856  0.00  0.00    +0.026 C 
ATOM     17  C   LIG    1       -3.321   0.959  -1.736  0.00  0.00    +0.045 C 
ATOM     18  C   LIG    1       -1.914   0.356  -1.756  0.00  0.00    +0.111 C 
ENDBRANCH   1   9
BRANCH   6  19
ATOM     19  C   LIG    1        3.229  -2.015   1.176  0.00  0.00    +0.093 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.394  -1.219   0.600  0.00  0.00    +0.074 A 
ATOM     21  C   LIG    1        4.369   0.266   0.626  0.00  0.00    +0.011 A 
ATOM     22  C   LIG    1        5.453   0.930   0.054  0.00  0.00    +0.050 A 
ATOM     23  C   LIG    1        5.506   2.329   0.033  0.00  0.00    +0.014 A 
ATOM     24  C   LIG    1        4.465   3.070   0.590  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        3.378   2.413   1.166  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        6.553   0.143  -0.526  0.00  0.00    +0.272 A 
ATOM     27  O   LIG    1        7.526   0.684  -1.040  0.00  0.00    -0.266 OA
ATOM     28  N   LIG    1        6.423  -1.222  -0.454  0.00  0.00    -0.242 N 
ATOM     29  H   LIG    1        7.174  -1.781  -0.847  0.00  0.00    +0.192 HD
ATOM     30  C   LIG    1        3.328   1.016   1.187  0.00  0.00    +0.010 A 
ATOM     31  N   LIG    1        5.376  -1.901   0.085  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   6  19
TORSDOF 3