%chk=000126125.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126125

0 1
 S    2.636100      -1.525000      0.5990000    
 F    4.268900       1.756100     -0.1095000    
 O  -0.4031000      -1.572100       1.046700    
 O   -3.147300      -2.459300      -1.098600    
 O   -1.669400      -4.248000      0.3161000    
 N   -1.978200      8.5199997E-02  0.4119000    
 N   -3.092100       2.018300      0.4052000    
 N   0.2450000      0.8861000     -0.1525000    
 N   0.2660000       3.307500     -0.4564000    
 N   -1.699300       4.650500     -0.2092000    
 C   -1.816500      -2.111200     -0.7755000    
 C  -0.9424000      -3.314700     -0.4829000    
 C   -1.732500      -1.349600      0.5385000    
 C   0.1736000      -2.708300      0.3621000    
 C    1.350400      -2.220200     -0.4710000    
 C   -1.062100       1.050900      0.1007000    
 C   -3.182400      0.7171000      0.5847000    
 C   -1.772200       2.240800      0.1022000    
 C    3.828300      -1.066100     -0.6804000    
 C   -1.059200       3.399200     -0.1900000    
 C    5.101300     -0.4414000     -0.1102000    
 C   0.8275000       2.074800     -0.4216000    
 C    4.859700      0.8293000      0.6908000    
 H   -1.396500      -1.526900      -1.602300    
 H  -0.6054000      -3.835800      -1.383500    
 H   -2.445500      -1.724400       1.283600    
 H   0.5133000      -3.416500       1.127700    
 H    1.037900      -1.449500      -1.181400    
 H    1.777100      -3.056500      -1.034300    
 H   -3.493100      -3.021300     -0.3845000    
 H   -1.069800      -4.986900      0.5169000    
 H   -4.085700      0.1791000      0.8378000    
 H    3.351800     -0.3607000      -1.369700    
 H    4.097400      -1.962300      -1.249300    
 H    5.763100     -0.2014000     -0.9512000    
 H    5.630200      -1.170900      0.5146000    
 H    1.886400       2.038500     -0.6477000    
 H    5.811400       1.247900       1.032000    
 H    4.225400      0.6752000       1.567000    
 H   -2.688000       4.721600     -9.8000001E-03
 H   -1.159400       5.477800     -0.4234000    


%chk=000126125-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126125

0 1
S 2.671583 -1.894518 1.274150
F 3.555521 0.399929 -1.771039
O -0.568895 -1.905859 1.226423
O -3.003137 -2.196106 -1.494775
O -1.714982 -4.233415 -0.469716
N -1.822060 0.071165 0.646460
N -2.503947 2.117919 1.446250
N -0.045323 0.844028 -0.933485
N 0.170739 3.293539 -0.949702
N -1.167586 4.705246 0.393392
C -1.697654 -1.899226 -0.945740
C -0.785637 -3.148190 -0.835416
C -1.759210 -1.385661 0.530751
C 0.195416 -2.805030 0.309174
C 1.481773 -2.132835 -0.189950
C -1.031870 1.029662 -0.006183
C -2.675131 0.788103 1.506977
C -1.473606 2.281671 0.499463
C 4.295214 -1.580510 0.334597
C -0.828209 3.444271 -0.014402
C 4.717464 -0.099198 0.321360
C 0.499803 2.028125 -1.350081
C 3.714107 0.820458 -0.363525
H -1.233730 -1.138717 -1.591889
H -0.268768 -3.380135 -1.785462
H -2.662240 -1.784935 1.029583
H 0.445623 -3.703929 0.904603
H 1.265490 -1.158460 -0.659436
H 1.993349 -2.798562 -0.909361
H -3.226549 -3.123700 -1.204077
H -1.251508 -5.105110 -0.459831
H -3.396329 0.279487 2.143703
H 4.160329 -1.957834 -0.692972
H 5.058715 -2.197209 0.837558
H 5.699915 -0.013940 -0.185078
H 4.851493 0.261028 1.360741
H 1.302466 1.950478 -2.089694
H 4.060829 1.868655 -0.390895
H 2.713720 0.750283 0.097816
H -1.906490 4.833167 1.081665
H -0.679986 5.502766 -0.009359


