%chk=000002319.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002319

0 1
 F   -4.288100       1.179500     -0.6140000    
 F   -4.092500     -0.8684000      -1.300900    
 F   -4.479200     -0.4614000      0.7998000    
 O  -0.2080000       3.530900     -0.2744000    
 O  -0.2409000      -3.368100       1.064500    
 O    1.677600       2.555200      0.2836000    
 O    1.654900      -2.272100       1.219400    
 N    1.839900      0.1477000      0.7840000    
 N   0.4472000       2.513400      5.0700001E-02
 N   0.4242000      -2.308900      0.9865000    
 C    2.812200     -7.2200000E-02 -0.2594000    
 C    2.123100     -0.4031000      -1.580500    
 C   0.4630000      0.1029000      0.5222000    
 C    2.317500      0.4086000       2.143200    
 C    3.117000     -0.6908000      -2.708600    
 C  -0.2305000       1.266400      0.1599000    
 C  -0.2418000      -1.105400      0.6200000    
 C    3.761600      0.8706000       2.109600    
 C   -2.291000      1.4800000E-02  1.1000000E-03
 C   -1.600400       1.222500     -9.9399999E-02
 C   -1.611500      -1.149100      0.3608000    
 C    2.401600      -1.080900      -3.992900    
 C   -3.755900     -3.1900000E-02 -0.2749000    
 H    3.436300      0.8128000     -0.4264000    
 H    3.480800     -0.9010000      2.6000000E-03
 H    1.485000      0.4260000      -1.908300    
 H    1.490000      -1.291400      -1.482300    
 H    1.707900       1.186600       2.618800    
 H    2.234400     -0.4833000       2.772200    
 H    3.790500      -1.503600      -2.412800    
 H    3.736600      0.1946000      -2.892300    
 H    4.446500      9.3599997E-02   1.756000    
 H    3.904100       1.775300       1.511100    
 H    4.079800       1.118100       3.129100    
 H   -2.149000       2.117900     -0.3810000    
 H   -2.178100      -2.074900      0.4307000    
 H    1.738400     -0.2786000      -4.331800    
 H    3.129200      -1.278200      -4.786500    
 H    1.802000      -1.985500      -3.849800    


%chk=000002319-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002319

0 1
F -4.623494 0.883023 1.030361
F -4.333035 0.705029 -1.206190
F -4.523553 -1.170130 0.053637
O -0.349578 3.402980 1.839004
O -0.221664 -3.311563 -0.548648
O 1.107814 3.016602 0.126177
O 1.216286 -2.642088 1.093813
N 1.804830 0.181104 0.643487
N 0.173753 2.646172 0.933283
N 0.273608 -2.408440 0.235544
C 2.710911 -0.638405 -0.201305
C 2.318619 -0.692115 -1.693617
C 0.422219 0.125910 0.541964
C 2.449369 0.835841 1.828128
C 3.416680 -1.390286 -2.530764
C -0.409367 1.289929 0.751321
C -0.329779 -1.060592 0.208525
C 3.573804 1.843021 1.519199
C -2.471447 0.103522 0.240043
C -1.804967 1.281426 0.648685
C -1.724430 -1.059804 0.000625
C 3.040495 -1.488083 -4.024547
C -3.956819 0.121731 0.038882
H 3.700180 -0.154291 -0.128458
H 2.819332 -1.663022 0.213056
H 2.163930 0.340834 -2.062207
H 1.366433 -1.233129 -1.848791
H 1.660304 1.320673 2.427418
H 2.849457 0.013519 2.458318
H 3.595754 -2.407347 -2.127580
H 4.370549 -0.834789 -2.423704
H 4.445970 1.364943 1.039962
H 3.216892 2.658923 0.871852
H 3.926003 2.279984 2.471205
H -2.357156 2.206171 0.840886
H -2.209981 -1.998054 -0.281167
H 2.873513 -0.485284 -4.460244
H 3.839900 -1.980848 -4.606668
H 2.113067 -2.074468 -4.161885


