REMARK  Name = BDB060423
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.686   0.607  -0.439  0.00  0.00    -0.299 N 
ATOM      2  C   LIG    1       -0.790  -0.526  -0.562  0.00  0.00    +0.114 C 
ATOM      3  C   LIG    1        0.577   0.140  -0.726  0.00  0.00    +0.045 C 
ATOM      4  C   LIG    1        0.446   1.387   0.152  0.00  0.00    +0.027 C 
ATOM      5  C   LIG    1       -0.999   1.835  -0.078  0.00  0.00    +0.108 C 
ENDROOT
BRANCH   1   9
ATOM      6  C   LIG    1       -5.890   2.556   0.661  0.00  0.00    +0.066 C 
ATOM      7  C   LIG    1       -5.084   1.335   0.338  0.00  0.00    +0.044 A 
ATOM      8  N   LIG    1       -3.767   1.505   0.110  0.00  0.00    -0.220 NA
ATOM      9  C   LIG    1       -3.017   0.431  -0.186  0.00  0.00    +0.219 A 
ATOM     10  N   LIG    1       -3.522  -0.803  -0.261  0.00  0.00    -0.208 NA
ATOM     11  CA  LIG    1       -4.843  -0.947  -0.027  0.00  0.00    +0.153 A 
ATOM     12  C   LIG    1       -5.682   0.100   0.279  0.00  0.00    +0.058 A 
BRANCH  11  13
ATOM     13  C   LIG    1       -5.355  -2.349  -0.118  0.00  0.00    +0.355 C 
ATOM     14  O   LIG    1       -4.708  -3.354  -0.353  0.00  0.00    -0.243 OA
BRANCH  13  15
ATOM     15  OXT LIG    1       -6.686  -2.436   0.097  0.00  0.00    -0.476 OA
ATOM     16  HXT LIG    1       -6.862  -3.397  -0.000  0.00  0.00    +0.295 HD
ENDBRANCH  13  15
ENDBRANCH  11  13
ENDBRANCH   1   9
BRANCH   3  17
ATOM     17  C   LIG    1        1.729  -0.772  -0.330  0.00  0.00    +0.234 C 
BRANCH  17  18
ATOM     18  O   LIG    1        2.948  -0.048  -0.503  0.00  0.00    -0.491 OA
BRANCH  18  19
ATOM     19  C   LIG    1        4.115  -0.656  -0.133  0.00  0.00    +0.132 A 
ATOM     20  C   LIG    1        5.267   0.146  -0.197  0.00  0.00    +0.096 A 
ATOM     21  C   LIG    1        6.511  -0.405   0.162  0.00  0.00    +0.016 A 
ATOM     22  C   LIG    1        6.608  -1.732   0.575  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        5.465  -2.522   0.633  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1        4.223  -1.988   0.280  0.00  0.00    +0.046 A 
BRANCH  20  25
ATOM     25  C   LIG    1        5.174   1.584  -0.642  0.00  0.00    +0.421 C 
ATOM     26  F   LIG    1        4.354   2.340   0.142  0.00  0.00    -0.166 F 
ATOM     27  F   LIG    1        6.380   2.228  -0.618  0.00  0.00    -0.166 F 
ATOM     28  F   LIG    1        4.721   1.726  -1.919  0.00  0.00    -0.166 F 
ENDBRANCH  20  25
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 7