REMARK  Name = BDB007479
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.061  -0.547   0.805  0.00  0.00    +0.122 A 
ATOM      2  N   LIG    1       -0.644  -1.732   1.278  0.00  0.00    -0.204 NA
ATOM      3  C   LIG    1        0.545  -2.194   0.832  0.00  0.00    +0.218 A 
ATOM      4  F   LIG    1        0.941  -3.385   1.311  0.00  0.00    -0.184 F 
ATOM      5  C   LIG    1        1.358  -1.536  -0.083  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1        0.906  -0.302  -0.552  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -0.313   0.199  -0.099  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   8
ATOM      8  N   LIG    1       -2.282  -0.092   1.309  0.00  0.00    -0.325 N 
ATOM      9  H   LIG    1       -2.563  -0.833   1.953  0.00  0.00    +0.148 HD
BRANCH   8  10
ATOM     10  C   LIG    1       -3.308   0.094   0.281  0.00  0.00    +0.143 C 
BRANCH  10  12
ATOM     11  C   LIG    1       -5.825   0.307   0.246  0.00  0.00    +0.219 A 
ATOM     12  C   LIG    1       -4.609   0.556   0.890  0.00  0.00    +0.034 A 
ATOM     13  C   LIG    1       -4.654   1.318   2.068  0.00  0.00    +0.050 A 
ATOM     14  C   LIG    1       -5.876   1.750   2.559  0.00  0.00    +0.142 A 
ATOM     15  F   LIG    1       -5.937   2.469   3.686  0.00  0.00    -0.204 F 
ATOM     16  C   LIG    1       -7.025   1.432   1.862  0.00  0.00    +0.153 A 
ATOM     17  N   LIG    1       -7.029   0.723   0.710  0.00  0.00    -0.218 NA
BRANCH  11  19
ATOM     18  C   LIG    1       -7.061  -0.634  -1.513  0.00  0.00    +0.279 C 
ATOM     19  O   LIG    1       -5.777  -0.391  -0.945  0.00  0.00    -0.479 OA
ENDBRANCH  11  19
ENDBRANCH  10  12
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   5  20
ATOM     20  C   LIG    1        2.664  -2.130  -0.523  0.00  0.00    +0.077 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.722  -1.465   0.295  0.00  0.00    -0.016 A 
ATOM     22  C   LIG    1        4.605  -0.416  -0.124  0.00  0.00    +0.022 A 
ATOM     23  C   LIG    1        5.423  -0.109   0.957  0.00  0.00    +0.138 A 
ATOM     24  N   LIG    1        6.392   0.821   1.018  0.00  0.00    -0.237 NA
ATOM     25  C   LIG    1        6.542   1.500  -0.143  0.00  0.00    +0.116 A 
ATOM     26  C   LIG    1        5.812   1.296  -1.314  0.00  0.00    -0.032 A 
ATOM     27  C   LIG    1        6.057   2.140  -2.525  0.00  0.00    +0.045 C 
ATOM     28  N   LIG    1        5.077  -0.929   1.993  0.00  0.00    -0.346 N 
ATOM     29  H   LIG    1        5.525  -0.904   2.897  0.00  0.00    +0.167 HD
ATOM     30  C   LIG    1        4.807   0.321  -1.305  0.00  0.00    +0.016 A 
ATOM     31  C   LIG    1        4.061  -1.764   1.607  0.00  0.00    +0.089 A 
ENDBRANCH  20  21
ENDBRANCH   5  20
TORSDOF 6