REMARK  Name = BDB061323
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.870  -0.308  -0.490  0.00  0.00    -0.324 N 
ATOM      2  C   LIG    1       -1.030  -1.068   0.460  0.00  0.00    +0.124 C 
ATOM      3  C   LIG    1        0.455  -1.104   0.036  0.00  0.00    +0.124 C 
ATOM      4  N   LIG    1        1.013   0.252  -0.129  0.00  0.00    -0.325 N 
ATOM      5  C   LIG    1        0.051   1.318  -0.469  0.00  0.00    +0.124 C 
ATOM      6  C   LIG    1       -1.172   0.760  -1.230  0.00  0.00    +0.124 C 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1       -3.531   2.264   0.610  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1       -3.969   0.894   0.250  0.00  0.00    +0.081 A 
ATOM      9  C   LIG    1       -3.199  -0.210  -0.214  0.00  0.00    +0.073 A 
ATOM     10  C   LIG    1       -4.094  -1.248  -0.332  0.00  0.00    +0.054 A 
ATOM     11  C   LIG    1       -3.947  -2.654  -0.770  0.00  0.00    +0.067 C 
ATOM     12  N   LIG    1       -5.304  -0.730   0.034  0.00  0.00    -0.280 N 
ATOM     13  H   LIG    1       -6.201  -1.201   0.061  0.00  0.00    +0.189 HD
ATOM     14  N   LIG    1       -5.261   0.562   0.391  0.00  0.00    -0.177 NA
ENDBRANCH   1   9
BRANCH   4  15
ATOM     15  C   LIG    1        2.349   0.535   0.124  0.00  0.00    +0.066 A 
ATOM     16  C   LIG    1        2.823   1.827   0.437  0.00  0.00    +0.144 A 
ATOM     17  F   LIG    1        1.973   2.863   0.540  0.00  0.00    -0.204 F 
ATOM     18  C   LIG    1        4.172   2.096   0.684  0.00  0.00    +0.041 A 
ATOM     19  C   LIG    1        5.109   1.071   0.625  0.00  0.00    +0.018 A 
ATOM     20  C   LIG    1        4.687  -0.223   0.315  0.00  0.00    +0.061 A 
ATOM     21  C   LIG    1        3.325  -0.478   0.069  0.00  0.00    +0.041 A 
BRANCH  20  22
ATOM     22  C   LIG    1        5.636  -1.360   0.231  0.00  0.00    +0.337 C 
ATOM     23  O   LIG    1        5.345  -2.516  -0.014  0.00  0.00    -0.245 OA
BRANCH  22  24
ATOM     24  O   LIG    1        6.910  -0.994   0.458  0.00  0.00    -0.477 OA
ATOM     25  H   LIG    1        7.415  -1.829   0.370  0.00  0.00    +0.295 HD
ENDBRANCH  22  24
ENDBRANCH  20  22
ENDBRANCH   4  15
TORSDOF 4