%chk=000046167.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046167

0 1
 F    8.209100       1.507200     -6.9200002E-02
 F    7.585800     -0.2646000       1.015200    
 F    7.560100     -0.2590000      -1.159200    
 O   -2.824800      -4.067300     -0.8557000    
 O   -4.116100      -1.706100     -7.1400002E-02
 O   -7.268200       1.741500      -2.000200    
 N   0.1513000      -2.100600      0.1573000    
 N    2.409800     -0.3650000     -5.7100002E-02
 C    1.461600      -2.520900      0.6693000    
 C   0.3270000      -1.252400      -1.027700    
 C    2.311400      -1.310300       1.062200    
 C    1.140000      3.9999999E-04 -0.6922000    
 C  -0.6718000      -3.266100     -0.1633000    
 C   -2.083900      -2.870300     -0.6013000    
 C    3.473400      0.5444000     -5.8200002E-02
 C   -2.833300      -2.047800      0.4447000    
 C    4.810200      9.8399997E-02 -6.1400000E-02
 C    3.239700       1.934100     -5.7900000E-02
 C    5.870000       1.005200     -6.4099997E-02
 C    4.299500       2.840900     -6.0500000E-02
 C    5.614800       2.376500     -6.3699998E-02
 C    7.276200      0.5092000     -6.7100003E-02
 C   -4.668100     -0.5362000      0.3774000    
 C   -5.525100      0.1828000     -0.4487000    
 C   -4.365800     -7.7000000E-02   1.654900    
 C   -6.086500       1.375300      8.0000004E-03
 C   -4.927100       1.115400       2.111600    
 C   -5.787500       1.841700       1.288100    
 C   -6.982700       2.132900     -0.8511000    
 C   -7.599000       3.437800     -0.3585000    
 H    1.333200      -3.150600       1.558100    
 H    1.998000      -3.118200     -8.0399998E-02
 H  -0.6285000     -0.8902000      -1.418200    
 H   0.8237000      -1.808600      -1.834200    
 H    3.297700      -1.672700       1.374200    
 H    1.866000     -0.8004000       1.926300    
 H   0.5605000      0.6478000     -2.1400001E-02
 H    1.318300      0.5507000      -1.624600    
 H  -0.2084000      -3.886700     -0.9426000    
 H  -0.7574000      -3.915300      0.7188000    
 H   -2.076300      -2.341800      -1.559600    
 H   -2.977400      -2.641100       1.355500    
 H   -2.247600      -1.149800      0.6731000    
 H    5.023700     -0.9688000     -7.4800000E-02
 H    2.228700       2.333500     -4.2700000E-02
 H   -3.724000      -3.804000      -1.116400    
 H    4.100900       3.908700     -5.7200000E-02
 H    6.426800       3.098300     -6.4999998E-02
 H   -5.744900     -0.1972000      -1.443200    
 H   -3.725400     -0.6260000       2.338400    
 H   -4.699700       1.474900       3.111000    
 H   -6.203200       2.763200       1.683500    
 H   -8.237300       3.851500      -1.145800    
 H   -8.223200       3.253400      0.5196000    
 H   -6.815100       4.168000     -0.1413000    


%chk=000046167-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000046167

0 1
F 8.667707 0.713879 0.976040
F 7.249960 1.079883 2.701665
F 7.394901 -0.984175 1.785728
O -2.949801 -3.509786 -1.164131
O -3.958875 -0.939185 -0.435985
O -8.340442 1.284525 -1.435521
N 0.290665 -1.839789 -0.329149
N 2.826630 -0.429001 -0.389282
C 1.412565 -2.260534 0.545952
C 0.845517 -1.322091 -1.603864
C 2.321340 -1.060171 0.853521
C 1.758659 -0.108009 -1.357795
C -0.722354 -2.906574 -0.525379
C -2.092076 -2.339583 -0.940987
C 4.008820 0.341340 -0.369935
C -2.683900 -1.424911 0.132713
C 5.089397 0.007807 0.501448
C 4.193353 1.460764 -1.242330
C 6.284889 0.752498 0.483321
C 5.402479 2.184206 -1.254428
C 6.466291 1.848550 -0.392785
C 7.373688 0.395456 1.453423
C -4.741920 -0.065505 0.334239
C -5.939298 0.375207 -0.268555
C -4.391744 0.374949 1.636938
C -6.801034 1.260772 0.421428
C -5.256925 1.259171 2.321505
C -6.454738 1.704852 1.728245
C -8.065463 1.700259 -0.272288
C -9.006962 2.656038 0.453148
H 1.001323 -2.648847 1.495454
H 2.021594 -3.071032 0.072762
H 0.021358 -1.007577 -2.268168
H 1.429476 -2.115278 -2.135504
H 3.161399 -1.405315 1.474593
H 1.741656 -0.316986 1.446067
H 1.141200 0.750067 -1.005706
H 2.215745 0.168105 -2.323205
H -0.417316 -3.657117 -1.291909
H -0.851177 -3.453484 0.427467
H -2.006021 -1.751764 -1.879990
H -2.883586 -1.998118 1.060940
H -1.998249 -0.582300 0.342328
H 5.023060 -0.853349 1.170533
H 3.387292 1.785568 -1.905081
H -3.866238 -3.179207 -1.351485
H 5.507818 3.033335 -1.938120
H 7.403902 2.410097 -0.400546
H -6.211533 0.040180 -1.274249
H -3.466609 0.043226 2.117067
H -4.985494 1.597963 3.327195
H -7.109769 2.388793 2.275866
H -9.871558 2.867554 -0.193682
H -9.363931 2.217282 1.403527
H -8.496569 3.606066 0.698248


