REMARK  Name = BDB061609
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.149  -3.197  -0.669  0.00  0.00    +0.184 C 
ENDROOT
BRANCH   1   8
ATOM      2  C   LIG    1       -4.530  -1.370  -0.475  0.00  0.00    +0.047 C 
ATOM      3  C   LIG    1       -3.208  -1.577   0.210  0.00  0.00    -0.007 A 
ATOM      4  C   LIG    1       -2.966  -1.143   1.526  0.00  0.00    +0.143 A 
ATOM      5  C   LIG    1       -1.771  -1.508   2.162  0.00  0.00    +0.083 A 
ATOM      6 CL   LIG    1       -1.497  -1.241   3.846  0.00  0.00    -0.080 Cl
ATOM      7  C   LIG    1       -0.766  -2.172   1.452  0.00  0.00    +0.029 A 
ATOM      8  C   LIG    1       -0.954  -2.521   0.110  0.00  0.00    -0.024 A 
ATOM      9  C   LIG    1       -2.178  -2.220  -0.499  0.00  0.00    +0.012 A 
BRANCH   4  10
ATOM     10  O   LIG    1       -3.954  -0.471   2.198  0.00  0.00    -0.473 OA
BRANCH  10  11
ATOM     11  C   LIG    1       -3.918   0.979   2.171  0.00  0.00    +0.200 C 
ATOM     12  C   LIG    1       -3.144   1.648   1.021  0.00  0.00    +0.067 C 
ATOM     13  C   LIG    1       -3.371   1.505   3.506  0.00  0.00    +0.067 C 
BRANCH  11  14
ATOM     14  C   LIG    1       -5.393   1.411   2.076  0.00  0.00    +0.348 C 
ATOM     15  O   LIG    1       -6.037   2.025   2.914  0.00  0.00    -0.247 OA
BRANCH  14  16
ATOM     16  O   LIG    1       -6.000   1.054   0.921  0.00  0.00    -0.478 OA
ATOM     17  H   LIG    1       -6.923   1.359   1.044  0.00  0.00    +0.295 HD
ENDBRANCH  14  16
ENDBRANCH  11  14
ENDBRANCH  10  11
ENDBRANCH   4  10
ENDBRANCH   1   8
BRANCH   1  18
ATOM     18  N   LIG    1        1.044  -2.238  -1.271  0.00  0.00    -0.208 N 
ATOM     19  C   LIG    1        2.164  -1.667  -0.652  0.00  0.00    +0.351 A 
ATOM     20  O   LIG    1        2.587  -1.976   0.451  0.00  0.00    -0.244 OA
ATOM     21  N   LIG    1        2.627  -0.715  -1.547  0.00  0.00    -0.250 N 
ATOM     22  C   LIG    1        1.756  -0.770  -2.581  0.00  0.00    +0.230 A 
ATOM     23  N   LIG    1        0.799  -1.637  -2.479  0.00  0.00    -0.157 NA
BRANCH  21  24
ATOM     24  C   LIG    1        3.740   0.150  -1.401  0.00  0.00    +0.052 A 
ATOM     25  C   LIG    1        4.554   0.114  -0.259  0.00  0.00    +0.027 A 
ATOM     26  C   LIG    1        5.651   0.975  -0.111  0.00  0.00    +0.014 A 
ATOM     27  C   LIG    1        5.973   1.900  -1.110  0.00  0.00    +0.055 A 
ATOM     28  C   LIG    1        5.169   1.947  -2.254  0.00  0.00    +0.014 A 
ATOM     29  C   LIG    1        4.072   1.084  -2.397  0.00  0.00    +0.027 A 
BRANCH  27  30
ATOM     30  C   LIG    1        7.141   2.845  -0.960  0.00  0.00    +0.417 C 
ATOM     31  F   LIG    1        6.741   4.135  -0.773  0.00  0.00    -0.166 F 
ATOM     32  F   LIG    1        7.952   2.547   0.093  0.00  0.00    -0.166 F 
ATOM     33  F   LIG    1        7.944   2.859  -2.061  0.00  0.00    -0.166 F 
ENDBRANCH  27  30
ENDBRANCH  21  24
ENDBRANCH   1  18
TORSDOF 8