%chk=000121245.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121245

0 1
 S   -2.797000      0.2084000      -2.493400    
 P   -2.413200      9.0700001E-02 -0.5869000    
 F    4.919100       2.863600      0.3236000    
 F    3.916500      -3.267000      0.3231000    
 O  -0.9734000      0.6668000     -9.5299996E-02
 O   -2.403400      -1.399700      6.5300003E-02
 O   -3.431000      0.8731000      0.4126000    
 N    2.653400      8.6800002E-02 -0.2383000    
 C    1.404900      0.7462000      0.1145000    
 C    3.798000      0.8135000      0.3169000    
 C    2.658300      -1.300000      0.2334000    
 C   0.2188000      1.5000000E-03 -0.4771000    
 C    3.827100       2.240100     -0.1960000    
 C    3.970800      -1.978000     -0.1091000    
 C   -3.612500      -2.133300      0.1629000    
 C   -3.723600       2.242200      0.1890000    
 C   -3.324900      -3.475400      0.8014000    
 C   -4.688000       2.720500       1.253400    
 H    1.280600      0.8398000       1.201800    
 H    1.340000       1.759800     -0.2935000    
 H    4.754900      0.3903000     -1.0000000E-03
 H    3.794500      0.8140000       1.414400    
 H    1.892300      -1.906700     -0.2579000    
 H    2.480900      -1.368900       1.314300    
 H   0.1290000      -1.017000     -9.6299998E-02
 H   0.2843000     -3.0999999E-02  -1.569700    
 H    3.904100       2.283000      -1.287000    
 H    2.976300       2.841800      0.1275000    
 H    4.835500      -1.551500      0.4016000    
 H    4.157700      -1.993200      -1.187400    
 H   -4.035000      -2.277900     -0.8358000    
 H   -4.329900      -1.575400      0.7723000    
 H   -4.179000       2.368600     -0.7971000    
 H   -2.795500       2.820900      0.2289000    
 H   -4.238800      -4.069000      0.8925000    
 H   -2.596400      -4.036700      0.2070000    
 H   -2.888600      -3.342900       1.796900    
 H   -4.935300       3.776100       1.111000    
 H   -5.612400       2.134000       1.227800    
 H   -4.256200       2.590100       2.251200    


%chk=000121245-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121245

0 1
S -2.386186 0.424067 -2.271915
P -2.352788 0.127258 -0.221749
F 4.750740 2.992062 -1.004640
F 4.240235 -3.343710 0.028659
O -0.876363 0.476336 0.602134
O -2.645315 -1.465114 0.363595
O -3.466012 1.025253 0.736452
N 2.835378 0.106176 0.418492
C 1.512377 0.532197 0.915206
C 3.872266 1.152833 0.333539
C 3.288135 -1.240371 0.819047
C 0.397826 0.002565 -0.000548
C 3.732964 1.935677 -0.979931
C 3.756219 -2.030199 -0.411387
C -3.805890 -2.226788 -0.195644
C -3.681190 2.473069 0.427872
C -3.650901 -3.660303 0.300935
C -4.947961 2.883058 1.171869
H 1.321295 0.189814 1.955003
H 1.461434 1.635980 0.925134
H 4.871819 0.682076 0.358839
H 3.828985 1.864452 1.187607
H 2.451280 -1.784592 1.293384
H 4.112556 -1.204980 1.564157
H 0.397013 -1.103632 -0.035351
H 0.504496 0.401327 -1.026771
H 3.905678 1.287350 -1.857203
H 2.750926 2.436604 -1.062994
H 4.601219 -1.534850 -0.924534
H 2.927121 -2.202830 -1.120400
H -3.778189 -2.162850 -1.300781
H -4.736265 -1.758997 0.176008
H -3.781921 2.596647 -0.667921
H -2.796709 3.035434 0.780153
H -4.495725 -4.273654 -0.063369
H -2.711047 -4.103606 -0.069019
H -3.645440 -3.693053 1.403377
H -5.144424 3.958749 1.007487
H -5.817692 2.308508 0.811127
H -4.837044 2.710240 2.255579


