REMARK  Name = BDB047165
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.468  -0.930  -0.220  0.00  0.00    +0.079 A 
ATOM      2  C   LIG    1       -1.352  -2.194  -0.818  0.00  0.00    +0.145 A 
ATOM      3  F   LIG    1       -2.332  -2.683  -1.593  0.00  0.00    -0.204 F 
ATOM      4  C   LIG    1       -0.278  -3.039  -0.544  0.00  0.00    +0.040 A 
ATOM      5  C   LIG    1        0.710  -2.642   0.351  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        0.626  -1.395   0.981  0.00  0.00    -0.040 A 
ATOM      7  C   LIG    1       -0.474  -0.561   0.703  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   1  12
ATOM      8  C   LIG    1       -5.532   0.672   0.383  0.00  0.00    +0.021 C 
ATOM      9  C   LIG    1       -4.358   1.423  -0.257  0.00  0.00    +0.051 C 
ATOM     10  C   LIG    1       -3.064   0.895   0.331  0.00  0.00    +0.232 C 
ATOM     11  O   LIG    1       -2.623   1.268   1.410  0.00  0.00    -0.274 OA
ATOM     12  N   LIG    1       -2.570  -0.074  -0.514  0.00  0.00    -0.207 N 
ATOM     13  C   LIG    1       -3.148   0.016  -1.762  0.00  0.00    +0.227 C 
ATOM     14  O   LIG    1       -2.814  -0.526  -2.807  0.00  0.00    -0.275 OA
ATOM     15  C   LIG    1       -4.220   1.068  -1.731  0.00  0.00    +0.112 C 
ATOM     16  C   LIG    1       -4.499   2.927  -0.038  0.00  0.00    +0.021 C 
ENDBRANCH   1  12
BRANCH   6  17
ATOM     17  C   LIG    1        1.675  -0.965   1.985  0.00  0.00    +0.093 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.100  -1.075   1.456  0.00  0.00    +0.074 A 
ATOM     19  C   LIG    1        3.638  -0.037   0.539  0.00  0.00    +0.011 A 
ATOM     20  C   LIG    1        4.941  -0.212   0.077  0.00  0.00    +0.050 A 
ATOM     21  C   LIG    1        5.522   0.719  -0.794  0.00  0.00    +0.014 A 
ATOM     22  C   LIG    1        4.792   1.833  -1.204  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        3.489   2.015  -0.744  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        5.709  -1.388   0.517  0.00  0.00    +0.272 A 
ATOM     25  O   LIG    1        6.859  -1.580   0.138  0.00  0.00    -0.266 OA
ATOM     26  N   LIG    1        5.063  -2.245   1.373  0.00  0.00    -0.242 N 
ATOM     27  H   LIG    1        5.578  -3.061   1.688  0.00  0.00    +0.192 HD
ATOM     28  C   LIG    1        2.910   1.085   0.126  0.00  0.00    +0.010 A 
ATOM     29  N   LIG    1        3.792  -2.110   1.836  0.00  0.00    -0.175 NA
ENDBRANCH  17  18
ENDBRANCH   6  17
TORSDOF 3