REMARK  Name = BDB040618
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.495   1.930  -0.457  0.00  0.00    +0.139 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.952   1.519  -0.397  0.00  0.00    -0.026 A 
ATOM      3  C   LIG    1       -1.705   1.740   0.764  0.00  0.00    +0.025 A 
ATOM      4  C   LIG    1       -3.047   1.343   0.841  0.00  0.00    +0.048 A 
ATOM      5 CL   LIG    1       -3.868   1.640   2.333  0.00  0.00    -0.083 Cl
ATOM      6  C   LIG    1       -3.674   0.713  -0.244  0.00  0.00    +0.018 A 
ATOM      7  C   LIG    1       -2.894   0.478  -1.387  0.00  0.00    +0.129 A 
ATOM      8  F   LIG    1       -3.432  -0.162  -2.436  0.00  0.00    -0.205 F 
ATOM      9  C   LIG    1       -1.560   0.869  -1.473  0.00  0.00    +0.044 A 
BRANCH   6  10
ATOM     10  C   LIG    1       -5.127   0.269  -0.223  0.00  0.00    +0.110 C 
ATOM     11  C   LIG    1       -5.919   0.794  -1.421  0.00  0.00    +0.227 C 
ATOM     12  O   LIG    1       -5.737   1.903  -1.919  0.00  0.00    -0.275 OA
ATOM     13  N   LIG    1       -6.933  -0.011  -1.885  0.00  0.00    -0.256 N 
ATOM     14  H   LIG    1       -7.464   0.357  -2.663  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1       -7.414  -1.169  -1.328  0.00  0.00    +0.219 C 
ATOM     16  O   LIG    1       -8.424  -1.712  -1.765  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1       -6.685  -1.682  -0.111  0.00  0.00    +0.097 C 
ATOM     18  C   LIG    1       -5.225  -1.258  -0.130  0.00  0.00    +0.027 C 
ENDBRANCH   6  10
ENDBRANCH   1   2
BRANCH   1  20
ATOM     19  C   LIG    1        1.784   0.969   1.422  0.00  0.00    +0.223 C 
ATOM     20  N   LIG    1        1.334   0.905   0.119  0.00  0.00    -0.310 N 
ATOM     21  H   LIG    1        1.545   0.093  -0.445  0.00  0.00    +0.149 HD
ATOM     22  O   LIG    1        1.544   1.927   2.152  0.00  0.00    -0.275 OA
BRANCH  19  24
ATOM     23  C   LIG    1        1.628  -1.462   1.912  0.00  0.00    +0.025 C 
ATOM     24  C   LIG    1        2.602  -0.263   1.891  0.00  0.00    +0.068 C 
ATOM     25  C   LIG    1        3.088  -0.035   3.338  0.00  0.00    +0.025 C 
BRANCH  24  26
ATOM     26  C   LIG    1        3.831  -0.470   0.999  0.00  0.00    -0.015 A 
ATOM     27  C   LIG    1        4.657   0.611   0.676  0.00  0.00    +0.119 A 
ATOM     28  N   LIG    1        5.758   0.536  -0.109  0.00  0.00    -0.221 NA
ATOM     29  C   LIG    1        6.068  -0.676  -0.604  0.00  0.00    +0.220 A 
ATOM     30  C   LIG    1        5.341  -1.820  -0.327  0.00  0.00    +0.068 A 
ATOM     31  C   LIG    1        4.210  -1.714   0.482  0.00  0.00    +0.011 A 
BRANCH  29  32
ATOM     32  O   LIG    1        7.184  -0.832  -1.388  0.00  0.00    -0.417 OA
BRANCH  32  33
ATOM     33  C   LIG    1        7.691   0.407  -1.842  0.00  0.00    +0.542 C 
ATOM     34  F   LIG    1        8.891   0.145  -2.429  0.00  0.00    -0.166 F 
ATOM     35  F   LIG    1        6.887   0.873  -2.833  0.00  0.00    -0.166 F 
ENDBRANCH  32  33
ENDBRANCH  29  32
ENDBRANCH  24  26
ENDBRANCH  19  24
ENDBRANCH   1  20
TORSDOF 7