REMARK  Name = BDB018925
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.440  -0.762   1.014  0.00  0.00    -0.300 N 
ATOM      2  C   LIG    1        0.899  -0.367   0.755  0.00  0.00    +0.038 A 
ATOM      3  C   LIG    1        1.996  -1.034   1.331  0.00  0.00    -0.025 A 
ATOM      4  C   LIG    1        3.308  -0.614   1.051  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1        3.560   0.498   0.235  0.00  0.00    -0.006 A 
ATOM      6  C   LIG    1        2.481   1.200  -0.319  0.00  0.00    +0.027 A 
ATOM      7  C   LIG    1        1.797  -2.221   2.234  0.00  0.00    +0.038 C 
ATOM      8  C   LIG    1        0.398  -2.222   2.824  0.00  0.00    +0.024 C 
ATOM      9  C   LIG    1        1.170   0.765  -0.035  0.00  0.00    +0.033 A 
ATOM     10  C   LIG    1       -0.615  -2.057   1.703  0.00  0.00    +0.111 C 
ENDROOT
BRANCH   1  16
ATOM     11  N   LIG    1       -5.117   0.631   0.131  0.00  0.00    -0.292 N 
ATOM     12  C   LIG    1       -3.818   0.176  -0.136  0.00  0.00    +0.072 A 
ATOM     13  C   LIG    1       -3.719  -0.053  -1.510  0.00  0.00    +0.070 A 
ATOM     14  C   LIG    1       -2.555  -0.509  -2.090  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1       -1.466  -0.738  -1.241  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1       -1.551  -0.509   0.157  0.00  0.00    +0.036 A 
ATOM     17  N   LIG    1       -4.958   0.248  -2.088  0.00  0.00    -0.295 N 
ATOM     18  C   LIG    1       -5.275   0.124  -3.481  0.00  0.00    +0.154 C 
ATOM     19  C   LIG    1       -2.756  -0.047   0.715  0.00  0.00    +0.051 A 
ATOM     20  C   LIG    1       -5.851   0.661  -1.077  0.00  0.00    +0.330 A 
ATOM     21  O   LIG    1       -7.023   0.973  -1.214  0.00  0.00    -0.246 OA
BRANCH  11  23
ATOM     22  C   LIG    1       -6.194  -0.320   2.121  0.00  0.00    +0.027 C 
ATOM     23  C   LIG    1       -5.660   0.925   1.432  0.00  0.00    +0.123 C 
ENDBRANCH  11  23
ENDBRANCH   1  16
BRANCH   5  24
ATOM     24  C   LIG    1        4.935   0.888   0.003  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1        5.880   0.084  -0.599  0.00  0.00    +0.116 A 
ATOM     26  N   LIG    1        7.032   0.814  -0.630  0.00  0.00    -0.274 N 
ATOM     27  C   LIG    1        8.308   0.404  -1.165  0.00  0.00    +0.172 C 
ATOM     28  N   LIG    1        6.904   2.041  -0.094  0.00  0.00    -0.179 NA
ATOM     29  C   LIG    1        5.628   2.082   0.302  0.00  0.00    +0.142 A 
ENDBRANCH   5  24
BRANCH   6  30
ATOM     30  C   LIG    1        2.675   2.413  -1.193  0.00  0.00    +0.372 C 
ATOM     31  F   LIG    1        1.558   2.752  -1.902  0.00  0.00    -0.204 F 
ATOM     32  F   LIG    1        2.997   3.525  -0.473  0.00  0.00    -0.204 F 
ENDBRANCH   6  30
TORSDOF 4