REMARK  Name = BDB027636
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.352  -1.228   0.044  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        1.151  -1.870   1.006  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.467  -1.419   1.092  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        3.263  -2.037   2.046  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.877  -3.032   2.887  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.607  -3.454   2.767  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.956  -0.447   0.310  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        2.126   0.088  -0.598  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        0.717  -2.914   1.857  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.839  -0.270  -0.756  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.662   1.163  -1.457  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        1.882   1.778  -2.446  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        2.432   2.785  -3.225  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        3.697   3.230  -3.092  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        4.446   2.635  -2.143  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        3.982   1.620  -1.319  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -0.993  -1.602  -0.082  0.00  0.00    -0.317 N 
ATOM     18  H   LIG    1       -1.443  -1.510   0.829  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.850  -0.994  -1.144  0.00  0.00    +0.180 C 
BRANCH  19  21
ATOM     20  F   LIG    1       -2.510  -1.036  -3.421  0.00  0.00    -0.169 F 
ATOM     21  C   LIG    1       -1.443  -1.269  -2.607  0.00  0.00    +0.408 C 
ATOM     22  F   LIG    1       -1.092  -2.562  -2.799  0.00  0.00    -0.169 F 
ATOM     23  F   LIG    1       -0.443  -0.490  -3.064  0.00  0.00    -0.169 F 
ENDBRANCH  19  21
BRANCH  19  24
ATOM     24  C   LIG    1       -2.143   0.504  -0.929  0.00  0.00    +0.066 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -2.726   0.810   0.433  0.00  0.00    -0.045 A 
ATOM     26  C   LIG    1       -1.918   1.354   1.441  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -2.444   1.607   2.708  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -3.781   1.321   2.979  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -4.593   0.784   1.982  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -4.070   0.529   0.714  0.00  0.00    +0.004 A 
ENDBRANCH  24  25
ENDBRANCH  19  24
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 6