REMARK  Name = BDB001533
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.819   1.532  -0.717  0.00  0.00    +0.164 A 
ATOM      2  C   LIG    1       -0.285   2.615  -1.395  0.00  0.00    +0.181 A 
ATOM      3  F   LIG    1       -1.060   3.568  -1.931  0.00  0.00    -0.200 F 
ATOM      4  C   LIG    1        1.080   2.682  -1.480  0.00  0.00    +0.156 A 
ATOM      5  N   LIG    1        1.897   1.757  -0.942  0.00  0.00    -0.220 NA
ATOM      6  C   LIG    1        1.319   0.730  -0.301  0.00  0.00    +0.221 A 
ATOM      7  N   LIG    1       -0.014   0.592  -0.179  0.00  0.00    -0.196 NA
ENDROOT
BRANCH   1   8
ATOM      8  N   LIG    1       -2.231   1.427  -0.643  0.00  0.00    -0.297 N 
ATOM      9  H   LIG    1       -2.645   2.345  -0.514  0.00  0.00    +0.154 HD
BRANCH   8  13
ATOM     10  C   LIG    1       -6.611   0.030   1.172  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -5.225  -0.321   0.719  0.00  0.00    -0.049 A 
ATOM     12  C   LIG    1       -4.355   0.678   0.252  0.00  0.00    +0.026 A 
ATOM     13  C   LIG    1       -3.036   0.387  -0.137  0.00  0.00    +0.033 A 
ATOM     14  C   LIG    1       -2.620  -0.947  -0.083  0.00  0.00    +0.023 A 
ATOM     15  C   LIG    1       -3.470  -1.950   0.393  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1       -4.763  -1.636   0.803  0.00  0.00    +0.003 A 
ENDBRANCH   8  13
ENDBRANCH   1   8
BRANCH   6  17
ATOM     17  N   LIG    1        2.063  -0.281   0.298  0.00  0.00    -0.284 N 
ATOM     18  H   LIG    1        1.430  -0.933   0.739  0.00  0.00    +0.155 HD
BRANCH  17  19
ATOM     19  C   LIG    1        3.430  -0.547   0.422  0.00  0.00    +0.034 A 
ATOM     20  C   LIG    1        4.436   0.254  -0.131  0.00  0.00    +0.027 A 
ATOM     21  C   LIG    1        5.791  -0.065   0.026  0.00  0.00    +0.047 A 
ATOM     22  C   LIG    1        6.150  -1.198   0.743  0.00  0.00    +0.117 A 
ATOM     23  C   LIG    1        5.178  -2.013   1.303  0.00  0.00    +0.047 A 
ATOM     24  C   LIG    1        3.828  -1.687   1.142  0.00  0.00    +0.027 A 
BRANCH  22  25
ATOM     25  O   LIG    1        7.455  -1.546   0.921  0.00  0.00    -0.507 OA
ATOM     26  H   LIG    1        8.012  -0.887   0.475  0.00  0.00    +0.292 HD
ENDBRANCH  22  25
ENDBRANCH  17  19
ENDBRANCH   6  17
TORSDOF 5