REMARK  Name = BDB033818
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.532   2.130  -0.724  0.00  0.00    -0.283 OA
ATOM      2  C   LIG    1       -0.058   1.058  -0.724  0.00  0.00    +0.235 A 
ATOM      3  C   LIG    1       -1.391   0.942  -0.117  0.00  0.00    +0.072 A 
ATOM      4  C   LIG    1       -2.071  -0.266  -0.239  0.00  0.00    +0.185 A 
ATOM      5  C   LIG    1       -3.325  -0.358   0.331  0.00  0.00    +0.209 A 
ATOM      6  O   LIG    1       -4.141  -1.447   0.318  0.00  0.00    -0.449 OA
ATOM      7  C   LIG    1       -5.281  -0.950   1.048  0.00  0.00    +0.467 C 
ATOM      8  O   LIG    1       -5.126   0.415   1.486  0.00  0.00    -0.452 OA
ATOM      9  C   LIG    1       -3.890   0.705   0.999  0.00  0.00    +0.170 A 
ATOM     10  C   LIG    1       -3.239   1.914   1.134  0.00  0.00    +0.050 A 
ATOM     11  O   LIG    1       -1.563  -1.348  -0.897  0.00  0.00    -0.443 OA
ATOM     12  C   LIG    1       -0.276  -1.274  -1.421  0.00  0.00    +0.254 A 
ATOM     13  C   LIG    1       -1.968   2.033   0.565  0.00  0.00    +0.019 A 
ATOM     14  C   LIG    1        0.503  -0.179  -1.341  0.00  0.00    +0.222 A 
ENDROOT
BRANCH  12  15
ATOM     15  C   LIG    1        0.152  -2.556  -2.072  0.00  0.00    +0.454 C 
ATOM     16  F   LIG    1        0.242  -3.559  -1.158  0.00  0.00    -0.163 F 
ATOM     17  F   LIG    1        1.352  -2.503  -2.700  0.00  0.00    -0.163 F 
ATOM     18  F   LIG    1       -0.749  -2.961  -3.005  0.00  0.00    -0.163 F 
ENDBRANCH  12  15
BRANCH  14  19
ATOM     19  O   LIG    1        1.779  -0.140  -1.882  0.00  0.00    -0.448 OA
BRANCH  19  20
ATOM     20  C   LIG    1        2.822   0.140  -1.028  0.00  0.00    +0.129 A 
ATOM     21  C   LIG    1        3.800   1.017  -1.496  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1        4.904   1.319  -0.697  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        5.035   0.731   0.560  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        4.067  -0.163   1.019  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        2.960  -0.465   0.224  0.00  0.00    +0.046 A 
ENDBRANCH  19  20
ENDBRANCH  14  19
TORSDOF 3