REMARK  Name = BDB061895
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.889  -0.115   0.674  0.00  0.00    +0.111 A 
ATOM      2  C   LIG    1        2.848  -1.026   1.710  0.00  0.00    +0.167 A 
ATOM      3  F   LIG    1        3.942  -1.465   2.347  0.00  0.00    -0.202 F 
ATOM      4  C   LIG    1        1.605  -1.464   2.086  0.00  0.00    +0.155 A 
ATOM      5  N   LIG    1        0.461  -1.056   1.501  0.00  0.00    -0.220 NA
ATOM      6  C   LIG    1        0.566  -0.167   0.501  0.00  0.00    +0.221 A 
ATOM      7  N   LIG    1        1.747   0.317   0.075  0.00  0.00    -0.211 NA
ENDROOT
BRANCH   1  13
ATOM      8  O   LIG    1        7.806   3.444  -1.716  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        7.753   2.257  -1.420  0.00  0.00    +0.244 C 
ATOM     10  C   LIG    1        6.510   1.627  -0.894  0.00  0.00    +0.040 A 
ATOM     11  C   LIG    1        6.525   0.303  -0.427  0.00  0.00    -0.033 A 
ATOM     12  C   LIG    1        5.346  -0.259   0.092  0.00  0.00    +0.014 A 
ATOM     13  C   LIG    1        4.139   0.467   0.139  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        4.157   1.785  -0.357  0.00  0.00    +0.011 A 
ATOM     15  C   LIG    1        7.814  -0.477  -0.428  0.00  0.00    +0.054 C 
ATOM     16  C   LIG    1        8.725   0.001  -1.554  0.00  0.00    +0.109 C 
ATOM     17  C   LIG    1        5.326   2.364  -0.862  0.00  0.00    +0.014 A 
ATOM     18  N   LIG    1        8.852   1.440  -1.556  0.00  0.00    -0.311 N 
ATOM     19  H   LIG    1        9.629   1.877  -2.036  0.00  0.00    +0.149 HD
ENDBRANCH   1  13
BRANCH   6  20
ATOM     20  N   LIG    1       -0.544   0.315  -0.163  0.00  0.00    -0.268 N 
ATOM     21  H   LIG    1       -0.305   0.965  -0.894  0.00  0.00    +0.156 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -1.906   0.104  -0.070  0.00  0.00    +0.125 A 
ATOM     23  N   LIG    1       -2.649   0.798  -0.954  0.00  0.00    -0.238 NA
ATOM     24  C   LIG    1       -4.000   0.640  -0.919  0.00  0.00    +0.136 A 
ATOM     25  C   LIG    1       -4.713  -0.165  -0.026  0.00  0.00    +0.048 A 
ATOM     26  C   LIG    1       -3.907  -0.881   0.859  0.00  0.00    +0.028 A 
ATOM     27  C   LIG    1       -2.511  -0.745   0.843  0.00  0.00    +0.045 A 
BRANCH  25  28
ATOM     28  N   LIG    1       -6.111  -0.263  -0.067  0.00  0.00    -0.326 N 
ATOM     29  C   LIG    1       -6.762  -1.298   0.763  0.00  0.00    +0.120 C 
ATOM     30  C   LIG    1       -8.268  -1.411   0.436  0.00  0.00    +0.100 C 
ATOM     31  N   LIG    1       -8.991  -0.129   0.550  0.00  0.00    -0.313 NA
ATOM     32  H   LIG    1       -8.897   0.205   1.509  0.00  0.00    +0.122 HD
ATOM     33  C   LIG    1       -8.335   0.847  -0.343  0.00  0.00    +0.100 C 
ATOM     34  C   LIG    1       -6.826   1.036  -0.061  0.00  0.00    +0.120 C 
ENDBRANCH  25  28
ENDBRANCH  20  22
ENDBRANCH   6  20
TORSDOF 4