REMARK  Name = BDB058296
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.309  -1.956   0.959  0.00  0.00    -0.275 OA
ATOM      2  C   LIG    1        1.271  -0.863   0.406  0.00  0.00    +0.218 C 
ATOM      3  N   LIG    1        2.340  -0.004   0.203  0.00  0.00    -0.285 N 
ATOM      4  H   LIG    1        2.136   0.866  -0.275  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        3.687  -0.202   0.573  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1        4.596   0.815   0.252  0.00  0.00    +0.069 A 
ATOM      7  C   LIG    1        5.955   0.710   0.579  0.00  0.00    +0.132 A 
ATOM      8  C   LIG    1        6.409  -0.431   1.236  0.00  0.00    +0.046 A 
ATOM      9  C   LIG    1        5.511  -1.450   1.560  0.00  0.00    +0.005 A 
ATOM     10  C   LIG    1        4.157  -1.337   1.231  0.00  0.00    +0.023 A 
BRANCH   7  11
ATOM     11  O   LIG    1        6.711   1.782   0.199  0.00  0.00    -0.406 OA
BRANCH  11  12
ATOM     12  C   LIG    1        8.097   1.752   0.494  0.00  0.00    +0.575 C 
ATOM     13  F   LIG    1        8.312   1.680   1.824  0.00  0.00    -0.133 F 
ATOM     14  F   LIG    1        8.705   0.715  -0.120  0.00  0.00    -0.133 F 
ATOM     15  F   LIG    1        8.659   2.895   0.040  0.00  0.00    -0.133 F 
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   3   5
BRANCH   2  16
ATOM     16  C   LIG    1       -0.023  -0.271  -0.128  0.00  0.00    +0.111 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -1.171  -1.280  -0.060  0.00  0.00    +0.094 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -2.412  -0.766  -0.674  0.00  0.00    -0.297 NA
ATOM     19  C   LIG    1       -3.027   0.296   0.151  0.00  0.00    +0.119 C 
ATOM     20  C   LIG    1       -4.404   0.722  -0.317  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1       -5.173  -0.106  -1.152  0.00  0.00    -0.042 A 
ATOM     22  C   LIG    1       -6.454   0.299  -1.549  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -6.982   1.508  -1.096  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.232   2.322  -0.250  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -4.591  -1.395  -1.669  0.00  0.00    +0.051 C 
ATOM     26  C   LIG    1       -4.951   1.931   0.140  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -3.381  -1.863  -0.849  0.00  0.00    +0.089 C 
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   2  16
TORSDOF 6