REMARK  Name = BDB011683
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.134   0.559  -0.371  0.00  0.00    +0.152 A 
ATOM      2  C   LIG    1        0.272   2.030  -0.408  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1       -0.876   2.824  -0.583  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1       -0.795   4.220  -0.611  0.00  0.00    +0.052 A 
ATOM      5  C   LIG    1        0.445   4.825  -0.470  0.00  0.00    +0.124 A 
ATOM      6  C   LIG    1        1.598   4.066  -0.307  0.00  0.00    +0.039 A 
ATOM      7  F   LIG    1        0.535   6.161  -0.497  0.00  0.00    -0.205 F 
ATOM      8  C   LIG    1       -2.191   2.164  -0.759  0.00  0.00    +0.257 A 
ATOM      9  O   LIG    1       -3.222   2.809  -0.906  0.00  0.00    -0.267 OA
ATOM     10  N   LIG    1       -2.191   0.790  -0.758  0.00  0.00    -0.319 N 
ATOM     11  H   LIG    1       -3.091   0.356  -0.926  0.00  0.00    +0.169 HD
ATOM     12  C   LIG    1        1.514   2.671  -0.278  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1       -1.077   0.001  -0.584  0.00  0.00    +0.092 A 
ENDROOT
BRANCH  13  14
ATOM     14  C   LIG    1       -1.292  -1.460  -0.630  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -0.598  -2.260  -1.551  0.00  0.00    +0.013 A 
ATOM     16  C   LIG    1       -0.810  -3.640  -1.591  0.00  0.00    +0.039 A 
ATOM     17  C   LIG    1       -1.719  -4.219  -0.714  0.00  0.00    +0.123 A 
ATOM     18  F   LIG    1       -1.922  -5.542  -0.752  0.00  0.00    -0.205 F 
ATOM     19  C   LIG    1       -2.421  -3.446   0.202  0.00  0.00    +0.039 A 
ATOM     20  C   LIG    1       -2.209  -2.066   0.244  0.00  0.00    +0.013 A 
ENDBRANCH  13  14
BRANCH   1  21
ATOM     21  O   LIG    1        1.297  -0.166  -0.196  0.00  0.00    -0.488 OA
BRANCH  21  22
ATOM     22  C   LIG    1        1.475  -0.548   1.176  0.00  0.00    +0.244 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.795  -1.319   1.290  0.00  0.00    +0.119 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.091  -1.766   2.650  0.00  0.00    -0.327 NA
ATOM     25  H   LIG    1        2.350  -2.384   2.981  0.00  0.00    +0.118 HD
ATOM     26  H   LIG    1        3.106  -0.969   3.286  0.00  0.00    +0.118 HD
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH   1  21
TORSDOF 5