REMARK  Name = BDB060656
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.164  -0.211  -1.023  0.00  0.00    +0.247 C 
ATOM      2  N   LIG    1        0.070  -1.063  -0.830  0.00  0.00    -0.290 N 
ATOM      3  O   LIG    1        1.729  -0.014  -2.095  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   7
ATOM      4  C   LIG    1        2.758   1.942   2.291  0.00  0.00    +0.052 A 
ATOM      5  C   LIG    1        1.755   2.516   1.499  0.00  0.00    +0.019 A 
ATOM      6  C   LIG    1        1.233   1.811   0.412  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        1.704   0.525   0.135  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1        2.721  -0.047   0.904  0.00  0.00    +0.014 A 
ATOM      9  C   LIG    1        3.243   0.662   1.989  0.00  0.00    +0.019 A 
BRANCH   4  11
ATOM     10  N   LIG    1        3.717   3.242   4.322  0.00  0.00    -0.191 NA
ATOM     11  C   LIG    1        3.291   2.665   3.410  0.00  0.00    +0.099 C 
ENDBRANCH   4  11
ENDBRANCH   1   7
BRANCH   2  12
ATOM     12  C   LIG    1       -0.536  -1.833  -1.964  0.00  0.00    +0.077 C 
ATOM     13  C   LIG    1       -0.869  -1.062  -3.262  0.00  0.00    +0.022 C 
ATOM     14  C   LIG    1       -0.422  -2.321  -4.037  0.00  0.00    +0.004 C 
ATOM     15  C   LIG    1        0.420  -2.712  -2.803  0.00  0.00    +0.022 C 
ENDBRANCH   2  12
BRANCH   2  16
ATOM     16  C   LIG    1       -0.509  -1.314   0.499  0.00  0.00    +0.143 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -1.426  -0.214   0.991  0.00  0.00    -0.030 A 
ATOM     18  C   LIG    1       -1.362   0.194   2.335  0.00  0.00    +0.008 A 
ATOM     19  C   LIG    1       -2.207   1.197   2.813  0.00  0.00    +0.038 A 
ATOM     20  C   LIG    1       -3.126   1.786   1.955  0.00  0.00    +0.123 A 
ATOM     21  F   LIG    1       -3.936   2.749   2.414  0.00  0.00    -0.205 F 
ATOM     22  C   LIG    1       -3.220   1.387   0.628  0.00  0.00    +0.038 A 
ATOM     23  C   LIG    1       -2.376   0.384   0.147  0.00  0.00    +0.008 A 
ENDBRANCH  16  17
ENDBRANCH   2  16
TORSDOF 5