REMARK  Name = BDB033125
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.551   1.333  -0.191  0.00  0.00    +0.127 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.752   1.361  -1.011  0.00  0.00    +0.094 C 
ATOM      3  N   LIG    1       -1.614   2.486  -0.682  0.00  0.00    -0.293 N 
ATOM      4  C   LIG    1       -1.380   3.569  -1.522  0.00  0.00    +0.216 C 
ATOM      5  O   LIG    1       -1.791   4.707  -1.371  0.00  0.00    -0.276 OA
ATOM      6  C   LIG    1       -0.477   3.110  -2.640  0.00  0.00    +0.098 C 
ATOM      7  C   LIG    1       -0.496   1.591  -2.500  0.00  0.00    +0.033 C 
BRANCH   3   8
ATOM      8  C   LIG    1       -2.238   2.664   0.620  0.00  0.00    +0.143 C 
BRANCH   8   9
ATOM      9  C   LIG    1       -2.979   1.438   1.091  0.00  0.00    -0.030 A 
ATOM     10  C   LIG    1       -4.102   0.977   0.385  0.00  0.00    +0.017 A 
ATOM     11  C   LIG    1       -4.798  -0.170   0.800  0.00  0.00    +0.055 A 
ATOM     12  C   LIG    1       -4.364  -0.846   1.949  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -3.253  -0.393   2.660  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -2.564   0.743   2.233  0.00  0.00    +0.005 A 
BRANCH  11  15
ATOM     15  C   LIG    1       -6.008  -0.642   0.031  0.00  0.00    +0.417 C 
ATOM     16  F   LIG    1       -7.107   0.125   0.268  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1       -5.815  -0.616  -1.318  0.00  0.00    -0.166 F 
ATOM     18  F   LIG    1       -6.372  -1.921   0.327  0.00  0.00    -0.166 F 
ENDBRANCH  11  15
ENDBRANCH   8   9
ENDBRANCH   3   8
ENDBRANCH   1   2
BRANCH   1  21
ATOM     19  O   LIG    1        3.271   1.077   0.405  0.00  0.00    -0.270 OA
ATOM     20  C   LIG    1        2.675   0.112  -0.053  0.00  0.00    +0.248 C 
ATOM     21  N   LIG    1        1.353   0.149  -0.462  0.00  0.00    -0.309 N 
ATOM     22  H   LIG    1        0.868  -0.746  -0.468  0.00  0.00    +0.149 HD
BRANCH  20  23
ATOM     23  C   LIG    1        3.351  -1.207  -0.172  0.00  0.00    +0.079 A 
ATOM     24  C   LIG    1        3.027  -2.139  -1.165  0.00  0.00    +0.129 A 
ATOM     25  C   LIG    1        3.659  -3.380  -1.200  0.00  0.00    +0.047 A 
ATOM     26  C   LIG    1        4.642  -3.690  -0.258  0.00  0.00    +0.016 A 
ATOM     27  C   LIG    1        4.999  -2.763   0.734  0.00  0.00    +0.056 A 
ATOM     28  C   LIG    1        4.351  -1.516   0.762  0.00  0.00    +0.029 A 
BRANCH  27  29
ATOM     29  C   LIG    1        6.087  -3.085   1.732  0.00  0.00    +0.417 C 
ATOM     30  F   LIG    1        5.907  -2.469   2.933  0.00  0.00    -0.166 F 
ATOM     31  F   LIG    1        6.177  -4.416   2.008  0.00  0.00    -0.166 F 
ATOM     32  F   LIG    1        7.318  -2.708   1.294  0.00  0.00    -0.166 F 
ENDBRANCH  27  29
BRANCH  24  33
ATOM     33  O   LIG    1        2.116  -1.897  -2.156  0.00  0.00    -0.506 OA
ATOM     34  H   LIG    1        2.020  -0.930  -2.254  0.00  0.00    +0.292 HD
ENDBRANCH  24  33
ENDBRANCH  20  23
ENDBRANCH   1  21
TORSDOF 8