REMARK  Name = BDB064774
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.319  -1.723   0.127  0.00  0.00    +0.117 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1       -4.051  -2.308  -2.145  0.00  0.00    +0.047 C 
ATOM      3  C   LIG    1       -2.683  -2.137  -1.543  0.00  0.00    -0.009 A 
ATOM      4  C   LIG    1       -2.386  -1.032  -0.730  0.00  0.00    +0.124 A 
ATOM      5  C   LIG    1       -1.102  -0.897  -0.186  0.00  0.00    +0.051 A 
ATOM      6  C   LIG    1       -0.095  -1.851  -0.436  0.00  0.00    -0.023 A 
ATOM      7  C   LIG    1       -0.412  -2.944  -1.254  0.00  0.00    +0.006 A 
ATOM      8  C   LIG    1       -1.689  -3.088  -1.798  0.00  0.00    +0.007 A 
BRANCH   4   9
ATOM      9  O   LIG    1       -3.418  -0.152  -0.536  0.00  0.00    -0.490 OA
BRANCH   9  10
ATOM     10  C   LIG    1       -3.187   0.994   0.283  0.00  0.00    +0.250 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -4.471   1.847   0.373  0.00  0.00    +0.086 C 
ATOM     12  C   LIG    1       -5.679   0.992   0.785  0.00  0.00    +0.030 C 
ATOM     13  C   LIG    1       -4.258   2.961   1.412  0.00  0.00    +0.030 C 
BRANCH  11  14
ATOM     14  C   LIG    1       -4.737   2.471  -0.942  0.00  0.00    +0.072 C 
ATOM     15  N   LIG    1       -4.944   2.990  -1.959  0.00  0.00    -0.196 NA
ENDBRANCH  11  14
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   4   9
ENDBRANCH   1   6
BRANCH   1  16
ATOM     16  N   LIG    1        1.799  -0.349  -0.052  0.00  0.00    -0.305 N 
ATOM     17  H   LIG    1        1.332   0.403   0.441  0.00  0.00    +0.149 HD
ATOM     18  C   LIG    1        2.525   0.039  -1.167  0.00  0.00    +0.252 C 
ATOM     19  O   LIG    1        3.002  -0.753  -1.975  0.00  0.00    -0.272 OA
BRANCH  18  20
ATOM     20  C   LIG    1        2.702   1.562  -1.272  0.00  0.00    +0.281 C 
ATOM     21  F   LIG    1        1.822   2.190  -0.417  0.00  0.00    -0.230 F 
BRANCH  20  22
ATOM     22  C   LIG    1        4.135   1.991  -1.020  0.00  0.00    -0.005 A 
ATOM     23  C   LIG    1        4.459   2.773   0.099  0.00  0.00    +0.008 A 
ATOM     24  C   LIG    1        5.779   3.171   0.331  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1        6.783   2.790  -0.556  0.00  0.00    +0.041 A 
ATOM     26 CL   LIG    1        8.407   3.279  -0.267  0.00  0.00    -0.084 Cl
ATOM     27  C   LIG    1        6.480   2.016  -1.673  0.00  0.00    +0.020 A 
ATOM     28  C   LIG    1        5.161   1.620  -1.906  0.00  0.00    +0.008 A 
ENDBRANCH  20  22
ENDBRANCH  18  20
ENDBRANCH   1  16
BRANCH   1  29
ATOM     29  C   LIG    1        1.514  -2.158   1.603  0.00  0.00    +0.119 C 
ATOM     30  C   LIG    1        0.486  -1.604   2.587  0.00  0.00    +0.021 C 
BRANCH  29  31
ATOM     31  C   LIG    1        1.591  -3.670   1.730  0.00  0.00    +0.310 C 
ATOM     32  O   LIG    1        1.186  -4.477   0.910  0.00  0.00    -0.251 OA
BRANCH  31  33
ATOM     33  O   LIG    1        2.181  -4.074   2.882  0.00  0.00    -0.480 OA
ATOM     34  H   LIG    1        2.496  -3.354   3.459  0.00  0.00    +0.295 HD
ENDBRANCH  31  33
ENDBRANCH  29  31
ENDBRANCH   1  29
TORSDOF 11