REMARK  Name = BDB019061
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.831  -0.062   0.005  0.00  0.00    +0.027 A 
ATOM      2  C   LIG    1        2.175  -0.766  -1.038  0.00  0.00    +0.078 A 
ATOM      3  N   LIG    1        0.806  -0.902  -0.938  0.00  0.00    -0.271 N 
ATOM      4  C   LIG    1        0.399  -1.583  -2.057  0.00  0.00    +0.206 A 
ATOM      5  N   LIG    1        1.410  -1.902  -2.838  0.00  0.00    -0.243 NA
ATOM      6  C   LIG    1        0.055  -0.389   0.139  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1        0.673   0.266   1.087  0.00  0.00    -0.223 NA
ATOM      8  C   LIG    1        2.520  -1.388  -2.215  0.00  0.00    +0.139 A 
ATOM      9  C   LIG    1        2.043   0.406   0.999  0.00  0.00    +0.125 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        6.994   0.642   0.223  0.00  0.00    +0.140 A 
ATOM     11  N   LIG    1        6.159   1.709   0.167  0.00  0.00    -0.244 NA
ATOM     12  C   LIG    1        4.832   1.444   0.097  0.00  0.00    +0.120 A 
ATOM     13  C   LIG    1        4.285   0.162   0.087  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        5.177  -0.913   0.141  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1        6.550  -0.675   0.212  0.00  0.00    +0.039 A 
BRANCH  10  17
ATOM     16  N   LIG    1        9.542   1.137   0.359  0.00  0.00    -0.189 NA
ATOM     17  C   LIG    1        8.398   0.941   0.297  0.00  0.00    +0.119 C 
ENDBRANCH  10  17
ENDBRANCH   1  13
BRANCH   6  18
ATOM     18  N   LIG    1       -1.310  -0.587   0.157  0.00  0.00    -0.310 N 
ATOM     19  H   LIG    1       -1.668  -1.389  -0.349  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.092  -0.277   1.342  0.00  0.00    +0.143 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -3.553  -0.349   1.007  0.00  0.00    +0.012 A 
ATOM     22  C   LIG    1       -4.181   0.606   0.212  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1       -3.620   1.790  -0.482  0.00  0.00    +0.080 C 
ATOM     24  C   LIG    1       -4.923   2.485  -0.877  0.00  0.00    +0.234 C 
ATOM     25  O   LIG    1       -5.987   1.507  -0.914  0.00  0.00    -0.491 OA
ATOM     26  C   LIG    1       -5.529   0.498  -0.108  0.00  0.00    +0.124 A 
ATOM     27  C   LIG    1       -6.310  -0.549   0.337  0.00  0.00    +0.049 A 
ATOM     28  C   LIG    1       -5.705  -1.515   1.141  0.00  0.00    +0.042 A 
ATOM     29  C   LIG    1       -4.346  -1.409   1.466  0.00  0.00    +0.129 A 
ATOM     30  F   LIG    1       -3.796  -2.367   2.226  0.00  0.00    -0.205 F 
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 5