REMARK  Name = BDB009056
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.325   1.503  -0.733  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.031   1.117  -1.089  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1        1.031   2.038  -1.069  0.00  0.00    -0.040 A 
ATOM      4  C   LIG    1        0.775   3.367  -0.711  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.515   3.764  -0.367  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1       -1.558   2.837  -0.378  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1       -1.458  -1.423  -1.202  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -2.442  -0.733  -0.949  0.00  0.00    +0.251 C 
ATOM      9  N   LIG    1       -2.433   0.629  -0.710  0.00  0.00    -0.281 N 
ATOM     10  H   LIG    1       -3.318   1.062  -0.469  0.00  0.00    +0.155 HD
BRANCH   8  11
ATOM     11  C   LIG    1       -3.770  -1.418  -0.880  0.00  0.00    +0.073 A 
ATOM     12  C   LIG    1       -4.958  -0.756  -0.565  0.00  0.00    +0.136 A 
ATOM     13  F   LIG    1       -4.969   0.560  -0.300  0.00  0.00    -0.205 F 
ATOM     14  C   LIG    1       -6.172  -1.439  -0.508  0.00  0.00    +0.039 A 
ATOM     15  C   LIG    1       -6.215  -2.809  -0.771  0.00  0.00    +0.015 A 
ATOM     16  C   LIG    1       -5.042  -3.504  -1.099  0.00  0.00    +0.056 A 
ATOM     17  C   LIG    1       -3.824  -2.799  -1.143  0.00  0.00    +0.028 A 
BRANCH  16  18
ATOM     18  C   LIG    1       -5.073  -4.992  -1.363  0.00  0.00    +0.417 C 
ATOM     19  F   LIG    1       -4.164  -5.388  -2.295  0.00  0.00    -0.166 F 
ATOM     20  F   LIG    1       -4.808  -5.717  -0.242  0.00  0.00    -0.166 F 
ATOM     21  F   LIG    1       -6.283  -5.426  -1.814  0.00  0.00    -0.166 F 
ENDBRANCH  16  18
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   3  22
ATOM     22  C   LIG    1        2.426   1.601  -1.452  0.00  0.00    +0.092 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.447   1.808  -0.337  0.00  0.00    +0.069 A 
ATOM     24  C   LIG    1        3.485   0.862   0.823  0.00  0.00    -0.016 A 
ATOM     25  C   LIG    1        2.563  -0.325   0.889  0.00  0.00    +0.037 C 
ATOM     26  C   LIG    1        2.977  -1.355   1.944  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1        3.368  -0.675   3.250  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1        4.530   0.296   3.034  0.00  0.00    +0.041 C 
ATOM     29  C   LIG    1        4.383   1.125   1.788  0.00  0.00    +0.023 A 
ATOM     30  C   LIG    1        5.295   2.289   1.659  0.00  0.00    +0.268 A 
ATOM     31  O   LIG    1        6.136   2.551   2.514  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1        5.146   3.045   0.528  0.00  0.00    -0.243 N 
ATOM     33  H   LIG    1        5.761   3.844   0.421  0.00  0.00    +0.192 HD
ATOM     34  N   LIG    1        4.240   2.832  -0.462  0.00  0.00    -0.175 NA
ENDBRANCH  22  23
ENDBRANCH   3  22
TORSDOF 5