%chk=000182275.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182275

0 1
S 3.390974 -0.149552 0.645055
S -3.555390 0.416977 -0.516463
O -2.451358 -0.787713 0.028946
O 3.632531 1.195075 1.240897
O -3.425572 1.537576 0.367843
O -3.322837 0.559256 -1.920418
C 1.628448 -0.291497 0.399556
C 3.868256 -0.044063 -1.122899
C -1.102649 -0.551327 0.137604
C 0.805557 0.803286 0.666189
C 1.094814 -1.523047 0.017132
C -0.580701 0.685621 0.537559
C -0.285438 -1.666296 -0.123428
C 5.378063 0.037408 -1.188421
C -4.985513 -0.499604 -0.188468
H 3.481537 -0.927269 -1.657421
H 3.406595 0.838105 -1.603792
H 1.248442 1.756298 0.984611
H 1.741837 -2.379617 -0.175855
H -1.229952 1.536576 0.764351
H -0.736918 -2.608035 -0.423019
H 5.760548 0.915517 -0.643222
H 5.867922 -0.849065 -0.767050
H 5.724342 0.135398 -2.226441
H -4.769400 -1.500021 0.232479
H -5.655955 -0.020713 0.544963
H -5.600083 -0.692873 -1.083487


%chk=000182275-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182275

0 1
S 3.570729 -0.555498 0.638936
S -3.446650 0.117524 -1.025528
O -2.501685 -0.513270 0.642247
O 3.926999 0.868085 1.448277
O -3.280623 1.718212 -1.234424
O -3.116724 -0.898173 -2.249801
C 1.667983 -0.571909 0.560080
C 3.843798 -0.062112 -1.250270
C -1.115981 -0.518261 0.579878
C 1.021183 0.535887 1.138502
C 0.969532 -1.664259 0.004915
C -0.386681 0.572797 1.132005
C -0.439461 -1.633435 0.005806
C 5.268421 0.465876 -1.391659
C -5.152567 -0.272285 -0.287420
H 3.631963 -0.977423 -1.828109
H 3.077505 0.706008 -1.440994
H 1.637759 1.334549 1.571455
H 1.501659 -2.523409 -0.419255
H -0.938547 1.418441 1.554088
H -1.028448 -2.450072 -0.422551
H 5.443128 1.273724 -0.658290
H 6.024448 -0.323736 -1.234163
H 5.413432 0.883369 -2.405081
H -5.141510 -1.346189 -0.062825
H -5.232591 0.343330 0.617479
H -5.888971 -0.001372 -1.056496


