REMARK  Name = BDB055362
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.739  -0.315  -0.151  0.00  0.00    +0.066 A 
ATOM      2  N   LIG    1        2.271  -1.331  -0.921  0.00  0.00    -0.319 N 
ATOM      3  H   LIG    1        1.654  -1.988  -1.384  0.00  0.00    +0.169 HD
ATOM      4  C   LIG    1        3.625  -1.562  -1.101  0.00  0.00    +0.273 A 
ATOM      5  O   LIG    1        4.020  -2.491  -1.797  0.00  0.00    -0.266 OA
ATOM      6  C   LIG    1        4.485  -0.630  -0.411  0.00  0.00    +0.114 A 
ATOM      7  N   LIG    1        3.937   0.384   0.352  0.00  0.00    -0.314 N 
ATOM      8  C   LIG    1        4.951   1.130   0.900  0.00  0.00    +0.129 A 
ATOM      9  C   LIG    1        6.132   0.576   0.476  0.00  0.00    +0.142 A 
ATOM     10  F   LIG    1        7.348   1.023   0.799  0.00  0.00    -0.204 F 
ATOM     11  C   LIG    1        5.861  -0.529  -0.347  0.00  0.00    +0.071 A 
ATOM     12  C   LIG    1        2.564   0.539   0.481  0.00  0.00    +0.117 A 
ENDROOT
BRANCH   1  16
ATOM     13  C   LIG    1       -2.553   0.011   0.080  0.00  0.00    -0.017 A 
ATOM     14  C   LIG    1       -1.889   0.025  -1.155  0.00  0.00    +0.007 A 
ATOM     15  C   LIG    1       -0.494  -0.083  -1.226  0.00  0.00    +0.010 A 
ATOM     16  C   LIG    1        0.277  -0.198  -0.063  0.00  0.00    -0.000 A 
ATOM     17  C   LIG    1       -0.374  -0.207   1.174  0.00  0.00    +0.010 A 
ATOM     18  C   LIG    1       -1.767  -0.101   1.243  0.00  0.00    +0.007 A 
BRANCH  13  20
ATOM     19  C   LIG    1       -4.449   1.531   0.716  0.00  0.00    +0.046 C 
ATOM     20  C   LIG    1       -4.070   0.136   0.207  0.00  0.00    +0.085 C 
ATOM     21  C   LIG    1       -4.853  -0.169  -1.077  0.00  0.00    +0.046 C 
BRANCH  20  22
ATOM     22  O   LIG    1       -4.527  -0.815   1.180  0.00  0.00    -0.385 OA
ATOM     23  H   LIG    1       -4.067  -1.653   0.995  0.00  0.00    +0.211 HD
ENDBRANCH  20  22
ENDBRANCH  13  20
ENDBRANCH   1  16
TORSDOF 3