REMARK  Name = BDB019063
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.121   0.481   0.253  0.00  0.00    +0.044 A 
ATOM      2  C   LIG    1       -2.378  -0.402  -0.571  0.00  0.00    +0.079 A 
ATOM      3  N   LIG    1       -1.010  -0.401  -0.410  0.00  0.00    -0.271 N 
ATOM      4  C   LIG    1       -0.517  -1.369  -1.245  0.00  0.00    +0.206 A 
ATOM      5  N   LIG    1       -1.464  -1.926  -1.971  0.00  0.00    -0.243 NA
ATOM      6  C   LIG    1       -0.345   0.445   0.495  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1       -1.036   1.245   1.263  0.00  0.00    -0.223 NA
ATOM      8  C   LIG    1       -2.628  -1.320  -1.565  0.00  0.00    +0.139 A 
ATOM      9  C   LIG    1       -2.412   1.247   1.112  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  12
ATOM     10  C   LIG    1       -5.007  -1.666   1.242  0.00  0.00    +0.173 C 
ATOM     11  N   LIG    1       -5.364  -0.383   0.678  0.00  0.00    -0.267 N 
ATOM     12  C   LIG    1       -4.533   0.622   0.237  0.00  0.00    +0.072 A 
ATOM     13  C   LIG    1       -5.371   1.648  -0.155  0.00  0.00    +0.049 A 
ATOM     14  C   LIG    1       -6.671   1.161   0.061  0.00  0.00    +0.135 A 
ATOM     15  N   LIG    1       -6.674  -0.074   0.563  0.00  0.00    -0.179 NA
ENDBRANCH   1  12
BRANCH   6  16
ATOM     16  N   LIG    1        1.029   0.429   0.604  0.00  0.00    -0.310 N 
ATOM     17  H   LIG    1        1.259   0.953   1.450  0.00  0.00    +0.149 HD
BRANCH  16  18
ATOM     18  C   LIG    1        1.829   0.989  -0.485  0.00  0.00    +0.143 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.282   0.983  -0.106  0.00  0.00    +0.012 A 
ATOM     20  C   LIG    1        3.999  -0.190   0.112  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1        3.553  -1.604   0.094  0.00  0.00    +0.080 C 
ATOM     22  C   LIG    1        4.914  -2.299   0.125  0.00  0.00    +0.234 C 
ATOM     23  O   LIG    1        5.895  -1.391   0.676  0.00  0.00    -0.491 OA
ATOM     24  C   LIG    1        5.340  -0.153   0.478  0.00  0.00    +0.124 A 
ATOM     25  C   LIG    1        6.027   1.032   0.644  0.00  0.00    +0.049 A 
ATOM     26  C   LIG    1        5.335   2.220   0.416  0.00  0.00    +0.042 A 
ATOM     27  C   LIG    1        3.984   2.187   0.046  0.00  0.00    +0.129 A 
ATOM     28  F   LIG    1        3.352   3.352  -0.158  0.00  0.00    -0.205 F 
ENDBRANCH  18  19
ENDBRANCH  16  18
ENDBRANCH   6  16
TORSDOF 4