REMARK  Name = BDB051818
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.457  -1.952   0.710  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.645  -2.303  -0.621  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.347  -2.847  -1.340  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.879  -2.102  -1.230  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.936  -1.548  -0.500  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -2.765  -1.182   0.846  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -1.519  -1.420   1.452  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        0.824  -2.927   2.366  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        0.830  -2.186   1.385  0.00  0.00    +0.249 C 
ATOM     10  N   LIG    1        1.968  -1.544   0.918  0.00  0.00    -0.294 N 
ATOM     11  C   LIG    1        1.985  -0.481  -0.099  0.00  0.00    +0.127 C 
ATOM     12  C   LIG    1        3.124   0.537   0.100  0.00  0.00    +0.127 C 
ATOM     13  N   LIG    1        4.420  -0.126   0.231  0.00  0.00    -0.297 N 
ATOM     14  C   LIG    1        4.460  -1.521   0.667  0.00  0.00    +0.127 C 
ATOM     15  C   LIG    1        3.251  -1.853   1.556  0.00  0.00    +0.127 C 
BRANCH  13  16
ATOM     16  C   LIG    1        5.521   0.396  -0.408  0.00  0.00    +0.218 A 
ATOM     17  N   LIG    1        5.457   1.647  -0.896  0.00  0.00    -0.223 NA
ATOM     18  C   LIG    1        6.552   2.143  -1.501  0.00  0.00    +0.116 A 
ATOM     19  C   LIG    1        7.721   1.444  -1.645  0.00  0.00    +0.039 A 
ATOM     20  C   LIG    1        7.702   0.178  -1.121  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1        6.630  -0.357  -0.508  0.00  0.00    -0.223 NA
ENDBRANCH  13  16
ENDBRANCH   1   9
BRANCH   6  22
ATOM     22  C   LIG    1       -3.891  -0.611   1.688  0.00  0.00    +0.090 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -4.908   0.226   0.948  0.00  0.00    +0.046 A 
ATOM     24  N   LIG    1       -4.642   1.538   0.477  0.00  0.00    -0.296 N 
ATOM     25  C   LIG    1       -5.623   2.231  -0.239  0.00  0.00    +0.114 A 
ATOM     26  C   LIG    1       -5.131   3.460  -0.629  0.00  0.00    +0.054 A 
ATOM     27  C   LIG    1       -3.824   3.560  -0.125  0.00  0.00    +0.078 A 
ATOM     28 CL   LIG    1       -2.820   4.915  -0.337  0.00  0.00    -0.080 Cl
ATOM     29  C   LIG    1       -6.925   1.659  -0.484  0.00  0.00    +0.273 A 
ATOM     30  O   LIG    1       -7.826   2.216  -1.101  0.00  0.00    -0.266 OA
ATOM     31  N   LIG    1       -7.098   0.397   0.042  0.00  0.00    -0.326 N 
ATOM     32  H   LIG    1       -8.010  -0.014  -0.121  0.00  0.00    +0.168 HD
ATOM     33  C   LIG    1       -3.556   2.397   0.556  0.00  0.00    +0.133 A 
ATOM     34 CL   LIG    1       -2.127   2.028   1.418  0.00  0.00    -0.062 Cl
ATOM     35  C   LIG    1       -6.134  -0.297   0.726  0.00  0.00    +0.108 A 
ENDBRANCH  22  23
ENDBRANCH   6  22
TORSDOF 4