REMARK  Name = BDB018571
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.216  -2.342   0.250  0.00  0.00    -0.002 A 
ATOM      2  C   LIG    1        0.107  -2.542  -0.367  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        0.528  -3.809  -0.555  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1       -0.222  -4.911  -0.182  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        0.331  -6.237  -0.411  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -1.465  -4.790   0.424  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1       -2.167  -5.728   0.791  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -1.954  -3.404   0.622  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -2.875   1.517   0.801  0.00  0.00    +0.041 A 
ATOM     10  N   LIG    1       -2.783   1.014  -0.454  0.00  0.00    -0.259 NA
ATOM     11  C   LIG    1       -2.269  -0.233  -0.586  0.00  0.00    +0.119 A 
ATOM     12  C   LIG    1       -1.830  -1.018   0.476  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -1.941  -0.477   1.758  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1       -2.467   0.803   1.924  0.00  0.00    +0.024 A 
BRANCH   9  16
ATOM     15  C   LIG    1       -2.273   3.941   0.945  0.00  0.00    +0.010 C 
ATOM     16  C   LIG    1       -3.401   2.921   0.938  0.00  0.00    +0.052 C 
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   2  17
ATOM     17  C   LIG    1        0.925  -1.435  -0.768  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1        1.292  -0.358   0.008  0.00  0.00    +0.123 A 
ATOM     19  N   LIG    1        2.008   0.507  -0.791  0.00  0.00    -0.238 N 
ATOM     20  N   LIG    1        2.219  -0.053  -2.019  0.00  0.00    -0.174 NA
ATOM     21  C   LIG    1        1.539  -1.198  -2.005  0.00  0.00    +0.143 A 
BRANCH  19  22
ATOM     22  C   LIG    1        2.530   1.815  -0.519  0.00  0.00    +0.085 A 
ATOM     23  C   LIG    1        2.292   2.551   0.657  0.00  0.00    +0.112 A 
ATOM     24  C   LIG    1        2.866   3.826   0.786  0.00  0.00    +0.143 A 
ATOM     25  F   LIG    1        2.656   4.549   1.898  0.00  0.00    -0.204 F 
ATOM     26  C   LIG    1        3.658   4.389  -0.209  0.00  0.00    +0.040 A 
ATOM     27  C   LIG    1        3.891   3.675  -1.374  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        3.332   2.404  -1.527  0.00  0.00    +0.029 A 
BRANCH  23  29
ATOM     29  C   LIG    1        1.487   2.129   1.761  0.00  0.00    +0.104 C 
ATOM     30  N   LIG    1        0.848   1.797   2.673  0.00  0.00    -0.191 NA
ENDBRANCH  23  29
ENDBRANCH  19  22
ENDBRANCH   2  17
TORSDOF 5