REMARK  Name = BDB009489
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.360   0.424   0.572  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.304   1.479   1.474  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.674   2.394   1.402  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.248   1.578   2.489  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.264   0.623   2.587  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -2.349  -0.433   1.663  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1       -1.374  -0.535   0.658  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  14
ATOM      8  O   LIG    1        5.922   0.927   2.149  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1        5.699   0.683   0.966  0.00  0.00    +0.248 C 
ATOM     10  N   LIG    1        4.460   0.236   0.495  0.00  0.00    -0.294 N 
ATOM     11  C   LIG    1        3.404   0.079   1.508  0.00  0.00    +0.127 C 
ATOM     12  C   LIG    1        2.267  -0.837   1.027  0.00  0.00    +0.127 C 
ATOM     13  N   LIG    1        1.785  -0.404  -0.290  0.00  0.00    -0.294 N 
ATOM     14  C   LIG    1        0.628   0.336  -0.508  0.00  0.00    +0.249 C 
ATOM     15  O   LIG    1        0.357   0.896  -1.567  0.00  0.00    -0.270 OA
ATOM     16  C   LIG    1        2.835  -0.362  -1.307  0.00  0.00    +0.127 C 
ATOM     17  C   LIG    1        3.971   0.571  -0.861  0.00  0.00    +0.127 C 
BRANCH   9  18
ATOM     18  C   LIG    1        6.815   0.839   0.017  0.00  0.00    +0.055 A 
ATOM     19  C   LIG    1        7.578   1.997   0.052  0.00  0.00    +0.123 A 
ATOM     20  N   LIG    1        8.637   2.220  -0.764  0.00  0.00    -0.263 NA
ATOM     21  C   LIG    1        8.960   1.229  -1.625  0.00  0.00    +0.111 A 
ATOM     22  C   LIG    1        8.274   0.026  -1.712  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1        7.184  -0.175  -0.869  0.00  0.00    +0.016 A 
ENDBRANCH   9  18
ENDBRANCH   1  14
BRANCH   6  24
ATOM     24  C   LIG    1       -3.451  -1.462   1.792  0.00  0.00    +0.092 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.101  -1.848   0.467  0.00  0.00    +0.069 A 
ATOM     26  C   LIG    1       -5.010  -0.881  -0.225  0.00  0.00    -0.016 A 
ATOM     27  C   LIG    1       -5.331   0.455   0.387  0.00  0.00    +0.037 C 
ATOM     28  C   LIG    1       -6.509   1.165  -0.290  0.00  0.00    +0.005 C 
ATOM     29  C   LIG    1       -6.414   1.061  -1.806  0.00  0.00    +0.005 C 
ATOM     30  C   LIG    1       -6.406  -0.402  -2.255  0.00  0.00    +0.041 C 
ATOM     31  C   LIG    1       -5.514  -1.269  -1.409  0.00  0.00    +0.023 A 
ATOM     32  C   LIG    1       -5.190  -2.611  -1.954  0.00  0.00    +0.268 A 
ATOM     33  O   LIG    1       -5.649  -3.006  -3.020  0.00  0.00    -0.266 OA
ATOM     34  N   LIG    1       -4.356  -3.381  -1.190  0.00  0.00    -0.243 N 
ATOM     35  H   LIG    1       -4.117  -4.300  -1.549  0.00  0.00    +0.192 HD
ATOM     36  N   LIG    1       -3.802  -3.024  -0.001  0.00  0.00    -0.175 NA
ENDBRANCH  24  25
ENDBRANCH   6  24
TORSDOF 4