%chk=000046455.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046455

0 1
 F    1.241200      -2.482200     -0.4440000    
 O   -3.288200      0.5890000     -3.2099999E-02
 N    2.621700     -0.3059000      0.3782000    
 C    1.644100      0.3325000     -0.4809000    
 C    1.653000       1.836600     -0.1770000    
 C   0.4694000       2.528200     -0.8375000    
 C   0.2769000     -0.3068000     -0.3253000    
 C  -0.8366000       1.985500     -0.2658000    
 C  -0.8918000      0.4781000     -0.2554000    
 C   0.1507000      -1.707700     -0.3283000    
 C   -2.142900     -0.1473000     -0.1294000    
 C    2.218600     -0.1869000       1.776300    
 C    3.940100      0.2856000      0.1683000    
 C   -1.099400      -2.316900     -0.2156000    
 C   -2.245400      -1.536800     -0.1100000    
 C   -3.711400      0.9549000       1.278600    
 H    1.921700      0.1880000      -1.534800    
 H    2.560000       2.311600     -0.5697000    
 H    1.594700       2.087000      0.8862000    
 H   0.5030000       2.364500      -1.922200    
 H   0.5220000       3.610700     -0.6745000    
 H   -1.662400       2.395400     -0.8593000    
 H  -0.9528000       2.343700      0.7642000    
 H    1.202200     -0.5294000       1.992200    
 H    2.348400      0.8091000       2.211600    
 H    2.863200     -0.8484000       2.370100    
 H    4.694700     -0.3472000      0.6507000    
 H    4.061500       1.289300      0.5902000    
 H    4.204800      0.3107000     -0.8952000    
 H   -1.176200      -3.400100     -0.2124000    
 H   -3.216100      -2.016800     -1.9600000E-02
 H   -4.016100      6.5300003E-02   1.839000    
 H   -4.574000       1.620500       1.186300    
 H   -2.920500       1.482300       1.820000    


%chk=000046455-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000046455

0 1
F 1.300812 -2.392590 -0.977428
O -3.354059 0.531258 0.086256
N 2.543807 -0.195532 0.606406
C 1.681962 0.390950 -0.465543
C 1.646229 1.957018 -0.451314
C 0.319586 2.544359 -0.972661
C 0.291230 -0.250386 -0.414786
C -0.849205 2.012037 -0.116006
C -0.898798 0.492673 -0.173852
C 0.156989 -1.640854 -0.634156
C -2.143291 -0.194303 -0.096522
C 2.116180 0.054698 1.990679
C 3.984533 0.007571 0.391576
C -1.064229 -2.327981 -0.572788
C -2.231564 -1.588437 -0.286403
C -3.632907 0.915955 1.480563
H 2.148899 0.062519 -1.416260
H 2.501280 2.345025 -1.035104
H 1.787377 2.307968 0.590686
H 0.159342 2.260233 -2.031538
H 0.351605 3.650024 -0.930951
H -1.820313 2.410671 -0.461311
H -0.712151 2.364759 0.928664
H 1.042917 -0.180569 2.099164
H 2.280052 1.103937 2.347953
H 2.678729 -0.614502 2.667670
H 4.552498 -0.623139 1.100483
H 4.328323 1.063794 0.533009
H 4.254755 -0.306598 -0.633029
H -1.092736 -3.405509 -0.756835
H -3.212167 -2.071438 -0.240519
H -3.712909 0.019589 2.126639
H -4.596969 1.447189 1.457097
H -2.847706 1.585711 1.883060


