REMARK  Name = BDB027676
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.538  -0.934   0.298  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -0.077  -2.257   0.188  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.262  -2.401  -0.174  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        1.730  -3.702  -0.275  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        1.007  -4.833  -0.061  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.284  -4.659   0.268  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.067  -1.357  -0.417  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.531  -0.132  -0.316  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -0.866  -3.413   0.404  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.256   0.116   0.032  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.406   1.023  -0.594  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        1.930   2.341  -0.531  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        2.792   3.394  -0.799  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.090   3.235  -1.123  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        4.544   1.968  -1.185  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        3.757   0.855  -0.935  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.872  -0.710   0.682  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1       -2.009  -1.179   1.582  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  CA  LIG    1       -2.421   0.654   0.799  0.00  0.00    +0.106 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.766   1.417   1.969  0.00  0.00    +0.178 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.902   0.646   3.168  0.00  0.00    -0.393 OA
ATOM     22  H   LIG    1       -1.403   1.115   3.861  0.00  0.00    +0.209 HD
ENDBRANCH  20  21
ENDBRANCH  19  20
BRANCH  19  23
ATOM     23  C   LIG    1       -2.426   1.454  -0.499  0.00  0.00    +0.137 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -3.341   0.853  -1.537  0.00  0.00    +0.392 C 
ATOM     25  F   LIG    1       -4.604   0.742  -1.067  0.00  0.00    -0.171 F 
ATOM     26  F   LIG    1       -2.943  -0.358  -1.967  0.00  0.00    -0.171 F 
ATOM     27  F   LIG    1       -3.394   1.666  -2.621  0.00  0.00    -0.171 F 
ENDBRANCH  23  24
ENDBRANCH  19  23
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7