REMARK  Name = BDB001618
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.321  -1.409  -0.023  0.00  0.00    +0.126 A 
ATOM      2  C   LIG    1       -0.989  -1.826  -0.013  0.00  0.00    +0.074 A 
ATOM      3  C   LIG    1        0.070  -0.949  -0.202  0.00  0.00    +0.080 A 
ATOM      4  C   LIG    1       -0.182   0.420  -0.405  0.00  0.00    +0.064 A 
ATOM      5  C   LIG    1        0.959   1.259  -0.628  0.00  0.00    +0.057 A 
ATOM      6  C   LIG    1        2.257   0.710  -0.549  0.00  0.00    +0.100 A 
ATOM      7  C   LIG    1        2.394  -0.662  -0.340  0.00  0.00    +0.138 A 
ATOM      8  C   LIG    1       -1.545   0.839  -0.377  0.00  0.00    +0.135 A 
ATOM      9  N   LIG    1        1.307  -1.466  -0.177  0.00  0.00    -0.244 NA
ATOM     10  C   LIG    1       -2.601  -0.066  -0.213  0.00  0.00    +0.092 A 
ENDROOT
BRANCH   7  11
ATOM     11  C   LIG    1        3.750  -1.355  -0.268  0.00  0.00    +0.384 C 
ATOM     12  F   LIG    1        3.689  -2.644  -0.739  0.00  0.00    -0.189 F 
ATOM     13  F   LIG    1        4.683  -0.757  -1.073  0.00  0.00    -0.189 F 
BRANCH  11  14
ATOM     14  C   LIG    1        4.253  -1.377   1.183  0.00  0.00    +0.460 C 
ATOM     15  F   LIG    1        3.424  -2.051   2.017  0.00  0.00    -0.165 F 
ATOM     16  F   LIG    1        4.382  -0.125   1.691  0.00  0.00    -0.165 F 
ATOM     17  F   LIG    1        5.472  -1.966   1.284  0.00  0.00    -0.165 F 
ENDBRANCH  11  14
ENDBRANCH   7  11
BRANCH   5  18
ATOM     18  N   LIG    1        0.790   2.665  -0.719  0.00  0.00    -0.356 N 
ATOM     19  H   LIG    1       -0.151   2.919  -1.028  0.00  0.00    +0.142 HD
ATOM     20  H   LIG    1        1.503   3.173  -1.236  0.00  0.00    +0.142 HD
ENDBRANCH   5  18
BRANCH   1  22
ATOM     21  C   LIG    1       -4.610  -2.038   0.136  0.00  0.00    +0.277 C 
ATOM     22  O   LIG    1       -3.236  -2.407   0.161  0.00  0.00    -0.495 OA
ENDBRANCH   1  22
BRANCH   6  23
ATOM     23  C   LIG    1        3.402   1.561  -0.686  0.00  0.00    +0.103 C 
ATOM     24  N   LIG    1        4.324   2.256  -0.804  0.00  0.00    -0.191 NA
ENDBRANCH   6  23
BRANCH   8  25
ATOM     25  O   LIG    1       -1.860   2.164  -0.596  0.00  0.00    -0.494 OA
ATOM     26  C   LIG    1       -2.361   2.768   0.602  0.00  0.00    +0.277 C 
ENDBRANCH   8  25
TORSDOF 6