REMARK  Name = BDB003708
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.002  -1.014  -0.374  0.00  0.00    +0.253 C 
ATOM      2  N   LIG    1       -1.314  -1.083   0.111  0.00  0.00    -0.296 N 
ATOM      3  C   LIG    1       -1.798  -0.277   1.243  0.00  0.00    +0.127 C 
ATOM      4  C   LIG    1       -3.075  -0.847   1.893  0.00  0.00    +0.124 C 
ATOM      5  N   LIG    1       -4.109  -1.162   0.889  0.00  0.00    -0.327 N 
ATOM      6  C   LIG    1       -3.597  -2.097  -0.144  0.00  0.00    +0.124 C 
ATOM      7  C   LIG    1       -2.352  -1.517  -0.838  0.00  0.00    +0.127 C 
ATOM      8  O   LIG    1        0.292  -1.454  -1.486  0.00  0.00    -0.272 OA
ENDROOT
BRANCH   5   9
ATOM      9  C   LIG    1       -5.037  -0.202   0.485  0.00  0.00    +0.030 A 
ATOM     10  C   LIG    1       -6.159  -0.580  -0.275  0.00  0.00    +0.035 A 
ATOM     11  C   LIG    1       -7.131   0.343  -0.706  0.00  0.00    +0.057 A 
ATOM     12  C   LIG    1       -6.997   1.686  -0.344  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -5.914   2.087   0.429  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1       -4.956   1.152   0.842  0.00  0.00    +0.023 A 
BRANCH  11  15
ATOM     15  C   LIG    1       -8.322  -0.127  -1.502  0.00  0.00    +0.417 C 
ATOM     16  F   LIG    1       -9.335  -0.572  -0.708  0.00  0.00    -0.166 F 
ATOM     17  F   LIG    1       -8.028  -1.157  -2.345  0.00  0.00    -0.166 F 
ATOM     18  F   LIG    1       -8.863   0.848  -2.285  0.00  0.00    -0.166 F 
ENDBRANCH  11  15
ENDBRANCH   5   9
BRANCH   1  19
ATOM     19  C   LIG    1        1.045  -0.386   0.560  0.00  0.00    +0.324 C 
BRANCH  19  20
ATOM     20  O   LIG    1        2.346  -0.409  -0.007  0.00  0.00    -0.479 OA
BRANCH  20  29
ATOM     21  C   LIG    1        7.005  -1.292  -1.919  0.00  0.00    +0.056 C 
ATOM     22  C   LIG    1        6.300  -0.070  -1.328  0.00  0.00    +0.109 C 
ATOM     23  O   LIG    1        4.920  -0.443  -1.064  0.00  0.00    -0.482 OA
ATOM     24  C   LIG    1        4.631   0.086   0.170  0.00  0.00    +0.166 A 
ATOM     25  C   LIG    1        5.746   0.588   0.825  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1        5.640   1.148   2.084  0.00  0.00    +0.007 A 
ATOM     27  C   LIG    1        4.376   1.202   2.674  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        3.245   0.691   2.007  0.00  0.00    +0.049 A 
ATOM     29  C   LIG    1        3.363   0.119   0.736  0.00  0.00    +0.163 A 
ATOM     30  C   LIG    1        6.956   0.364   0.001  0.00  0.00    +0.086 C 
ATOM     31  C   LIG    1        6.289   1.071  -2.353  0.00  0.00    +0.056 C 
ENDBRANCH  20  29
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 5