REMARK  Name = BDB017156
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.100  -1.103  -1.028  0.00  0.00    +0.167 C 
ATOM      2  O   LIG    1       -0.382  -1.913  -1.911  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1        5.887   0.883   0.783  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1        5.461   0.059  -0.260  0.00  0.00    +0.054 A 
ATOM      5  C   LIG    1        4.094  -0.223  -0.444  0.00  0.00    -0.014 A 
ATOM      6  C   LIG    1        3.140   0.335   0.438  0.00  0.00    -0.017 A 
ATOM      7  C   LIG    1        1.774   0.053   0.256  0.00  0.00    +0.020 A 
ATOM      8  C   LIG    1        1.343  -0.772  -0.790  0.00  0.00    +0.018 A 
ATOM      9  C   LIG    1        2.295  -1.322  -1.657  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1        3.581   1.160   1.482  0.00  0.00    +0.012 A 
ATOM     11  C   LIG    1        3.654  -1.050  -1.487  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1        4.941   1.429   1.650  0.00  0.00    +0.046 A 
BRANCH   3  14
ATOM     13  C   LIG    1        8.188   0.701   0.208  0.00  0.00    +0.277 C 
ATOM     14  O   LIG    1        7.181   1.228   1.062  0.00  0.00    -0.495 OA
ENDBRANCH   3  14
ENDBRANCH   1   8
BRANCH   1  15
ATOM     15  C   LIG    1       -1.180  -0.446  -0.171  0.00  0.00    +0.074 C 
ATOM     16  C   LIG    1       -2.520  -0.431  -0.933  0.00  0.00    +0.096 C 
ATOM     17  N   LIG    1       -3.598  -0.040  -0.008  0.00  0.00    -0.298 NA
ATOM     18  C   LIG    1       -3.824  -1.103   0.995  0.00  0.00    +0.085 C 
ATOM     19  C   LIG    1       -2.585  -1.958   1.296  0.00  0.00    +0.016 C 
ATOM     20  C   LIG    1       -1.298  -1.148   1.193  0.00  0.00    +0.014 C 
BRANCH  17  21
ATOM     21  C   LIG    1       -4.840   0.215  -0.754  0.00  0.00    +0.068 C 
ATOM     22  C   LIG    1       -4.745   1.576  -1.485  0.00  0.00    +0.094 C 
ATOM     23  C   LIG    1       -6.192   1.837  -1.008  0.00  0.00    +0.252 C 
ATOM     24  F   LIG    1       -7.165   1.419  -1.851  0.00  0.00    -0.206 F 
ATOM     25  F   LIG    1       -6.485   3.114  -0.676  0.00  0.00    -0.206 F 
ATOM     26  C   LIG    1       -5.885   0.885   0.171  0.00  0.00    +0.094 C 
ENDBRANCH  17  21
ENDBRANCH   1  15
TORSDOF 4