REMARK  Name = BDB008876
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.831  -0.783   0.795  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.952  -0.206   2.055  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        2.081   0.418   2.423  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.103  -0.271   2.960  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.297  -0.896   2.591  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -1.449  -1.447   1.307  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.370  -1.393   0.413  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  N   LIG    1        3.140  -1.303   0.056  0.00  0.00    -0.299 N 
ATOM      9  C   LIG    1        1.917  -0.682  -0.192  0.00  0.00    +0.249 C 
ATOM     10  O   LIG    1        1.668  -0.058  -1.223  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1        3.467  -2.043   1.267  0.00  0.00    +0.132 C 
BRANCH   8  12
ATOM     12  C   LIG    1        4.252  -0.990  -0.848  0.00  0.00    +0.123 C 
BRANCH  12  13
ATOM     13  C   LIG    1        4.930   0.351  -0.497  0.00  0.00    +0.102 C 
BRANCH  13  15
ATOM     14  C   LIG    1        5.855   0.854  -2.690  0.00  0.00    +0.104 C 
ATOM     15  N   LIG    1        6.157   0.623  -1.274  0.00  0.00    -0.307 NA
ATOM     16  C   LIG    1        6.842   1.797  -0.723  0.00  0.00    +0.104 C 
ENDBRANCH  13  15
ENDBRANCH  12  13
ENDBRANCH   8  12
ENDBRANCH   1   9
BRANCH   6  17
ATOM     17  C   LIG    1       -2.747  -2.105   0.898  0.00  0.00    +0.092 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -3.964  -1.201   1.069  0.00  0.00    +0.069 A 
ATOM     19  C   LIG    1       -4.208  -0.089   0.096  0.00  0.00    -0.016 A 
ATOM     20  C   LIG    1       -3.299   0.127  -1.083  0.00  0.00    +0.037 C 
ATOM     21  C   LIG    1       -3.888   1.067  -2.139  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1       -4.529   2.287  -1.489  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -5.645   1.872  -0.528  0.00  0.00    +0.041 C 
ATOM     24  C   LIG    1       -5.277   0.693   0.329  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1       -6.164   0.417   1.487  0.00  0.00    +0.268 A 
ATOM     26  O   LIG    1       -7.156   1.099   1.720  0.00  0.00    -0.266 OA
ATOM     27  N   LIG    1       -5.809  -0.646   2.272  0.00  0.00    -0.243 N 
ATOM     28  H   LIG    1       -6.404  -0.852   3.068  0.00  0.00    +0.192 HD
ATOM     29  N   LIG    1       -4.729  -1.451   2.090  0.00  0.00    -0.175 NA
ENDBRANCH  17  18
ENDBRANCH   6  17
TORSDOF 6