REMARK  Name = BDB027843
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.501  -0.776  -0.407  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1       -0.110  -2.008  -1.000  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1        1.240  -2.386  -0.877  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1        1.599  -3.598  -1.446  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        0.776  -4.444  -2.119  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.500  -4.049  -2.242  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.164  -1.630  -0.254  0.00  0.00    -0.245 NA
ATOM      8  C   LIG    1        1.794  -0.441   0.272  0.00  0.00    +0.074 A 
ATOM      9  C   LIG    1       -0.983  -2.864  -1.712  0.00  0.00    +0.031 A 
ATOM     10  C   LIG    1        0.483   0.017   0.187  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.870   0.327   0.928  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        4.190   0.255   0.459  0.00  0.00    +0.030 A 
ATOM     13  C   LIG    1        5.180   0.990   1.091  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.957   1.788   2.155  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        3.690   1.841   2.611  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        2.634   1.143   2.044  0.00  0.00    +0.030 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -1.850  -0.328  -0.522  0.00  0.00    -0.330 N 
ATOM     18  H   LIG    1       -2.482  -1.124  -0.418  0.00  0.00    +0.147 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -2.456   0.882   0.045  0.00  0.00    +0.128 C 
ATOM     20  C   LIG    1       -1.883   2.186  -0.586  0.00  0.00    +0.035 C 
ATOM     21  C   LIG    1       -3.327   2.658  -0.831  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1       -3.768   1.186  -0.751  0.00  0.00    +0.035 C 
BRANCH  19  24
ATOM     23  F   LIG    1       -3.301  -0.293   1.923  0.00  0.00    -0.168 F 
ATOM     24  C   LIG    1       -2.662   0.848   1.564  0.00  0.00    +0.411 C 
ATOM     25  F   LIG    1       -3.410   1.891   1.993  0.00  0.00    -0.168 F 
ATOM     26  F   LIG    1       -1.483   0.892   2.228  0.00  0.00    -0.168 F 
ENDBRANCH  19  24
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 4