REMARK  Name = BDB064094
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.192  -0.185  -2.734  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.035  -1.295  -3.545  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.971  -1.875  -4.215  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.313  -1.832  -3.664  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.379  -1.247  -2.976  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -2.173  -0.111  -2.179  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -0.879   0.422  -2.068  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1   9
ATOM      8  O   LIG    1        1.647   1.617  -2.785  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        1.536   0.405  -2.602  0.00  0.00    +0.250 C 
ATOM     10  N   LIG    1        2.619  -0.404  -2.267  0.00  0.00    -0.288 N 
ATOM     11  C   LIG    1        2.494  -1.672  -1.536  0.00  0.00    +0.184 C 
ATOM     12  C   LIG    1        3.135  -1.532  -0.194  0.00  0.00    +0.151 A 
ATOM     13  N   LIG    1        3.050  -2.344   0.837  0.00  0.00    -0.132 NA
ATOM     14  N   LIG    1        3.804  -1.808   1.857  0.00  0.00    -0.126 NA
ATOM     15  C   LIG    1        4.337  -0.678   1.433  0.00  0.00    +0.202 A 
ATOM     16  N   LIG    1        3.961  -0.483   0.135  0.00  0.00    -0.306 N 
ATOM     17  C   LIG    1        4.281   0.604  -0.770  0.00  0.00    +0.144 C 
ATOM     18  C   LIG    1        3.945   0.211  -2.208  0.00  0.00    +0.130 C 
BRANCH  15  19
ATOM     19  C   LIG    1        5.156   0.176   2.229  0.00  0.00    +0.204 A 
ATOM     20  O   LIG    1        5.677   1.363   1.789  0.00  0.00    -0.351 OA
ATOM     21  N   LIG    1        6.427   1.956   2.789  0.00  0.00    -0.086 NA
ATOM     22  C   LIG    1        6.345   1.125   3.829  0.00  0.00    +0.157 A 
ATOM     23  C   LIG    1        5.564  -0.004   3.535  0.00  0.00    +0.076 A 
ENDBRANCH  15  19
ENDBRANCH   1   9
BRANCH   6  24
ATOM     24  C   LIG    1       -3.319   0.513  -1.414  0.00  0.00    +0.093 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -3.416   0.101   0.053  0.00  0.00    +0.074 A 
ATOM     26  C   LIG    1       -4.508   0.684   0.876  0.00  0.00    +0.011 A 
ATOM     27  C   LIG    1       -4.579   0.296   2.213  0.00  0.00    +0.050 A 
ATOM     28  C   LIG    1       -5.580   0.803   3.050  0.00  0.00    +0.014 A 
ATOM     29  C   LIG    1       -6.516   1.704   2.544  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1       -6.450   2.096   1.208  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1       -3.587  -0.655   2.739  0.00  0.00    +0.272 A 
ATOM     32  O   LIG    1       -3.613  -1.022   3.908  0.00  0.00    -0.266 OA
ATOM     33  N   LIG    1       -2.643  -1.097   1.845  0.00  0.00    -0.242 N 
ATOM     34  H   LIG    1       -1.944  -1.749   2.189  0.00  0.00    +0.192 HD
ATOM     35  C   LIG    1       -5.449   1.590   0.372  0.00  0.00    +0.010 A 
ATOM     36  N   LIG    1       -2.549  -0.740   0.537  0.00  0.00    -0.175 NA
ENDBRANCH  24  25
ENDBRANCH   6  24
TORSDOF 4