REMARK  Name = BDB027663
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.766  -0.877  -0.075  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -0.355  -2.217  -0.160  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.023  -2.419  -0.084  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        1.450  -3.737  -0.155  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        0.653  -4.829  -0.298  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -0.667  -4.598  -0.387  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        1.903  -1.416   0.046  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.415  -0.167   0.090  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -1.215  -3.330  -0.324  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.108   0.137   0.032  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.378   0.944   0.210  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.762   0.714   0.258  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        4.630   1.789   0.370  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        4.227   3.074   0.439  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        2.898   3.290   0.395  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        1.956   2.280   0.282  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -2.155  -0.569  -0.139  0.00  0.00    -0.315 N 
ATOM     18  H   LIG    1       -2.627  -1.131   0.571  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -2.559   0.890  -0.070  0.00  0.00    +0.129 C 
ATOM     20  C   LIG    1       -2.357   1.747  -1.312  0.00  0.00    +0.037 C 
ATOM     21  C   LIG    1       -3.734   1.278  -0.964  0.00  0.00    +0.037 C 
BRANCH  19  23
ATOM     22  F   LIG    1       -1.267   2.244   1.434  0.00  0.00    -0.168 F 
ATOM     23  C   LIG    1       -2.437   1.580   1.298  0.00  0.00    +0.411 C 
ATOM     24  F   LIG    1       -2.522   0.661   2.293  0.00  0.00    -0.168 F 
ATOM     25  F   LIG    1       -3.437   2.475   1.494  0.00  0.00    -0.168 F 
ENDBRANCH  19  23
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 4