REMARK  Name = BDB001511
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.671  -2.453  -1.694  0.00  0.00    -0.297 N 
ATOM      2  H   LIG    1       -0.532  -2.750  -2.655  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -2.045  -2.183  -1.462  0.00  0.00    +0.164 A 
ATOM      4  C   LIG    1       -2.978  -3.015  -2.056  0.00  0.00    +0.181 A 
ATOM      5  F   LIG    1       -2.617  -4.020  -2.865  0.00  0.00    -0.200 F 
ATOM      6  C   LIG    1       -4.296  -2.753  -1.795  0.00  0.00    +0.156 A 
ATOM      7  N   LIG    1       -4.703  -1.744  -1.003  0.00  0.00    -0.220 NA
ATOM      8  C   LIG    1       -3.750  -0.975  -0.452  0.00  0.00    +0.221 A 
ATOM      9  N   LIG    1       -2.435  -1.171  -0.659  0.00  0.00    -0.196 NA
BRANCH   8  10
ATOM     10  N   LIG    1       -4.054   0.097   0.380  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -3.194   0.538   0.672  0.00  0.00    +0.155 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -5.243   0.652   0.864  0.00  0.00    +0.034 A 
ATOM     13  C   LIG    1       -6.517   0.154   0.567  0.00  0.00    +0.027 A 
ATOM     14  C   LIG    1       -7.673   0.755   1.081  0.00  0.00    +0.047 A 
ATOM     15  C   LIG    1       -7.559   1.868   1.902  0.00  0.00    +0.117 A 
ATOM     16  C   LIG    1       -6.312   2.387   2.215  0.00  0.00    +0.047 A 
ATOM     17  C   LIG    1       -5.164   1.781   1.698  0.00  0.00    +0.027 A 
BRANCH  15  18
ATOM     18  O   LIG    1       -8.656   2.485   2.425  0.00  0.00    -0.507 OA
ATOM     19  H   LIG    1       -9.448   2.010   2.124  0.00  0.00    +0.292 HD
ENDBRANCH  15  18
ENDBRANCH  10  12
ENDBRANCH   8  10
ENDBRANCH   1   3
BRANCH   1  23
ATOM     20  C   LIG    1        2.843  -0.784  -0.020  0.00  0.00    +0.037 A 
ATOM     21  C   LIG    1        1.647  -0.744   0.700  0.00  0.00    +0.015 A 
ATOM     22  C   LIG    1        0.476  -1.281   0.151  0.00  0.00    +0.024 A 
ATOM     23  C   LIG    1        0.472  -1.862  -1.122  0.00  0.00    +0.032 A 
ATOM     24  C   LIG    1        1.693  -1.939  -1.812  0.00  0.00    +0.024 A 
ATOM     25  C   LIG    1        2.869  -1.402  -1.274  0.00  0.00    +0.015 A 
BRANCH  20  27
ATOM     26  O   LIG    1        4.207  -0.288   1.809  0.00  0.00    -0.270 OA
ATOM     27  C   LIG    1        4.068  -0.201   0.595  0.00  0.00    +0.248 C 
ATOM     28  N   LIG    1        4.921   0.427  -0.296  0.00  0.00    -0.281 N 
ATOM     29  H   LIG    1        4.591   0.532  -1.246  0.00  0.00    +0.155 HD
BRANCH  28  30
ATOM     30  C   LIG    1        6.166   1.028  -0.010  0.00  0.00    +0.035 A 
ATOM     31  C   LIG    1        6.817   1.683  -1.062  0.00  0.00    +0.043 A 
ATOM     32  C   LIG    1        8.054   2.295  -0.853  0.00  0.00    +0.043 A 
ATOM     33 CL   LIG    1        8.839   3.098  -2.158  0.00  0.00    -0.083 Cl
ATOM     34  C   LIG    1        8.659   2.261   0.400  0.00  0.00    +0.020 A 
ATOM     35  C   LIG    1        8.019   1.608   1.450  0.00  0.00    +0.003 A 
ATOM     36  C   LIG    1        6.779   0.993   1.245  0.00  0.00    +0.023 A 
ENDBRANCH  28  30
ENDBRANCH  20  27
ENDBRANCH   1  23
TORSDOF 7