REMARK  Name = BDB020009
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.718  -1.931  -0.689  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -1.508  -3.052  -0.405  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -2.914  -2.995  -0.417  0.00  0.00    -0.043 A 
ATOM      4  C   LIG    1       -3.497  -1.750  -0.731  0.00  0.00    +0.009 A 
ATOM      5  C   LIG    1       -2.727  -0.614  -1.039  0.00  0.00    -0.027 A 
ATOM      6  C   LIG    1       -1.331  -0.725  -1.033  0.00  0.00    +0.018 A 
ENDROOT
BRANCH   1   9
ATOM      7  N   LIG    1        1.458  -0.914  -0.322  0.00  0.00    -0.304 N 
ATOM      8  H   LIG    1        0.957  -0.085  -0.035  0.00  0.00    +0.150 HD
ATOM      9  C   LIG    1        0.764  -2.062  -0.629  0.00  0.00    +0.245 C 
ATOM     10  O   LIG    1        1.292  -3.152  -0.820  0.00  0.00    -0.270 OA
BRANCH   7  11
ATOM     11  C   LIG    1        2.903  -0.873  -0.256  0.00  0.00    +0.107 C 
BRANCH  11  18
ATOM     12  C   LIG    1        3.135   3.957   1.329  0.00  0.00    +0.047 C 
ATOM     13  C   LIG    1        3.471   2.508   1.501  0.00  0.00    -0.015 A 
ATOM     14  C   LIG    1        4.199   2.086   2.615  0.00  0.00    +0.126 A 
ATOM     15  F   LIG    1        4.604   2.983   3.526  0.00  0.00    -0.205 F 
ATOM     16  C   LIG    1        4.515   0.746   2.805  0.00  0.00    +0.039 A 
ATOM     17  C   LIG    1        4.097  -0.203   1.872  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1        3.359   0.184   0.741  0.00  0.00    -0.027 A 
ATOM     19  C   LIG    1        3.047   1.548   0.572  0.00  0.00    +0.011 A 
ENDBRANCH  11  18
BRANCH  11  20
ATOM     20  C   LIG    1        3.458  -0.575  -1.630  0.00  0.00    +0.014 C 
ATOM     21  C   LIG    1        4.892  -0.905  -1.970  0.00  0.00    +0.006 C 
ATOM     22  C   LIG    1        3.776  -1.698  -2.589  0.00  0.00    +0.006 C 
ENDBRANCH  11  20
ENDBRANCH   7  11
ENDBRANCH   1   9
BRANCH   3  23
ATOM     23  C   LIG    1       -3.718  -4.241  -0.090  0.00  0.00    +0.019 C 
ATOM     24  C   LIG    1       -5.051  -4.514  -0.745  0.00  0.00    +0.009 C 
ATOM     25  C   LIG    1       -4.994  -4.158   0.713  0.00  0.00    +0.009 C 
ENDBRANCH   3  23
BRANCH   5  26
ATOM     26  C   LIG    1       -3.390   0.709  -1.361  0.00  0.00    +0.159 C 
BRANCH  26  27
ATOM     27  N   LIG    1       -3.051   1.717  -0.375  0.00  0.00    -0.313 N 
ATOM     28  C   LIG    1       -1.978   2.615  -0.457  0.00  0.00    +0.204 A 
ATOM     29  N   LIG    1       -1.178   2.859  -1.433  0.00  0.00    -0.268 NA
ATOM     30  H   LIG    1       -1.445   2.304  -2.245  0.00  0.00    +0.190 HD
ATOM     31  N   LIG    1       -1.940   3.219   0.802  0.00  0.00    -0.320 N 
ATOM     32  C   LIG    1       -1.048   4.302   1.133  0.00  0.00    +0.152 C 
ATOM     33  C   LIG    1       -2.961   2.727   1.597  0.00  0.00    +0.106 A 
ATOM     34  C   LIG    1       -3.626   1.802   0.892  0.00  0.00    +0.107 A 
ENDBRANCH  26  27
ENDBRANCH   5  26
TORSDOF 7