%chk=000060770.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060770

0 1
 F    5.007900      0.8997000      -1.587000    
 F    3.424300       2.310200      -1.132300    
 F    5.700800      0.8020000       1.099700    
 F    4.106200       2.216700       1.554800    
 F    5.719000       2.786100      0.1972000    
 O    2.277900      0.9024000      -2.917800    
 O    1.772700      -1.267400      -3.319200    
 N    1.775100      -1.479700     -0.2906000    
 N    3.149800     -0.3558000       1.009300    
 N   -3.167500       2.566100     -0.1938000    
 N   -3.267700       1.774800       1.925600    
 N   -2.284800       3.130500      0.6424000    
 N   -2.308800       2.692400       1.908800    
 C    2.268400      -1.329900      0.9620000    
 C   0.7746000      -2.470200     -0.7020000    
 C    2.356100     -0.5659000      -1.103300    
 C    1.844000      -2.172100       2.099100    
 C    3.209100      0.1248000     -0.2749000    
 C  -0.6151000      -1.945500     -0.5679000    
 C    3.032900      -2.659300       2.950900    
 C    4.108500       1.241700     -0.6073000    
 C   -1.215500      -1.280100      -1.636700    
 C   -1.314200      -2.120100      0.6263000    
 C    2.108700     -0.3939000      -2.499300    
 C   -3.214300     -0.9638000     -0.3172000    
 C    4.000500      -3.524400       2.159000    
 C    4.915600       1.767600      0.5720000    
 C   -2.515100     -0.7892000      -1.511400    
 C   -2.613900      -1.629300      0.7517000    
 C   -4.562700     -0.4554000     -0.1873000    
 C   -4.821200      0.8356000      0.2798000    
 C   -5.626200      -1.288600     -0.5427000    
 C   -6.135100       1.290500      0.3909000    
 C   -6.940100     -0.8338000     -0.4314000    
 C   -3.755200       1.727500      0.6574000    
 C   -7.194700      0.4558000      3.5399999E-02
 H   0.9206000      -3.389800     -0.1279000    
 H   0.9847000      -2.776800      -1.730300    
 H    1.286000      -3.062700       1.809700    
 H    1.179500      -1.580100       2.740100    
 H    3.574100      -1.802800       3.370500    
 H    2.645100      -3.237500       3.797900    
 H  -0.6970000      -1.143700      -2.579600    
 H  -0.8784000      -2.650400       1.465800    
 H    3.484900      -4.378300       1.707800    
 H    4.494000      -2.959200       1.362500    
 H    4.781600      -3.913300       2.820200    
 H   -2.969400     -0.2751000      -2.355200    
 H   -3.146400      -1.777100       1.688300    
 H   -5.448900      -2.297400     -0.9088000    
 H    2.102600      0.9975000      -3.878300    
 H   -6.352600       2.292600      0.7533000    
 H   -7.765200      -1.483600     -0.7083000    
 H   -8.217800      0.8098000      0.1220000    
 H   -1.635900       3.846900      0.3345000    


%chk=000060770-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000060770

0 1
F 5.620238 0.098029 -2.150927
F 4.046713 1.758053 -2.304837
F 5.984135 0.694647 0.599818
F 4.407181 2.334346 0.462908
F 6.249757 2.413213 -0.841015
O 3.461219 -0.542620 -3.899954
O 1.563680 -1.868876 -3.757676
N 1.853610 -1.688536 -0.778111
N 3.280293 -0.365850 0.373531
N -4.186512 2.057408 2.719719
N -3.199328 -0.019470 2.691102
N -3.280063 1.883131 3.724796
N -2.658958 0.641525 3.741962
C 2.275524 -1.270804 0.482161
C 0.742693 -2.657501 -1.025091
C 2.635295 -1.013746 -1.740103
C 1.680967 -1.746833 1.777946
C 3.512459 -0.201662 -0.981867
C -0.634887 -2.040530 -0.808800
C 2.523525 -1.361437 3.017689
C 4.573102 0.754509 -1.426688
C -1.116044 -1.029669 -1.678525
C -1.460601 -2.471635 0.256546
C 2.471467 -1.203329 -3.184508
C -3.202373 -0.860618 -0.375750
C 3.872710 -2.106262 3.104386
C 5.295883 1.543663 -0.275279
C -2.384734 -0.454386 -1.466116
C -2.727021 -1.889635 0.474906
C -4.560213 -0.243689 -0.214765
C -4.976243 0.537313 0.910985
C -5.471846 -0.395261 -1.295446
C -6.272335 1.126657 0.915315
C -6.757518 0.182489 -1.276124
C -4.117666 0.843062 2.071747
C -7.161412 0.950892 -0.160828
H 0.894824 -3.511460 -0.342314
H 0.849957 -3.006146 -2.063334
H 1.555959 -2.849347 1.744753
H 0.658037 -1.329559 1.875218
H 2.705831 -0.271663 3.002657
H 1.915918 -1.579574 3.916862
H -0.503219 -0.704149 -2.526262
H -1.113244 -3.265858 0.928862
H 3.727500 -3.203821 3.108965
H 4.521636 -1.841165 2.251996
H 4.409475 -1.834677 4.031224
H -2.744103 0.331890 -2.139906
H -3.341879 -2.226669 1.312299
H -5.156951 -0.992602 -2.158009
H 3.306074 -0.666877 -4.874521
H -6.566988 1.732389 1.778222
H -7.436879 0.033117 -2.122197
H -8.155759 1.408393 -0.130776
H -3.067389 2.610186 4.407552


