%chk=000285586.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285586

0 1
S 2.787554 -0.850998 1.087322
O -6.993176 -0.489245 1.681531
O -2.802658 1.001349 -1.937864
O 6.135733 0.942904 0.437274
O 5.553211 -0.717241 1.706933
N -2.040489 -0.592569 -0.424694
N -0.766911 -0.123251 -0.480743
N 5.317585 0.161585 0.890390
C -5.076305 -0.131241 0.236957
C -4.411370 -0.576508 -1.065478
C -6.492387 -0.709198 0.358842
C -3.043700 0.062972 -1.225892
C 1.509891 -0.141578 0.139287
C 1.985743 0.898799 -0.626871
C 3.950039 0.258115 0.444448
C 3.384535 1.132274 -0.455704
C 0.168344 -0.683540 0.247869
H -4.483372 -0.448258 1.119369
H -5.112040 0.976622 0.288676
H -4.358163 -1.681699 -1.130400
H -5.031446 -0.264458 -1.938306
H -6.505834 -1.813472 0.276867
H -7.187830 -0.275323 -0.380623
H -2.304329 -1.375804 0.186502
H 1.364440 1.487998 -1.297380
H 3.931632 1.912209 -0.979553
H 0.033981 -1.530390 0.937883
H -7.141776 0.464148 1.843558


%chk=000285586-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285586

0 1
S 3.185329 -1.277292 0.396607
O -7.936124 -0.024705 0.760293
O -3.011900 1.314241 -0.682286
O 6.351862 1.140307 0.132708
O 6.134862 -1.101330 0.604937
N -1.871869 -0.671331 -0.159187
N -0.632963 -0.081555 -0.184965
N 5.647257 0.066600 0.308854
C -5.486333 0.008229 0.272533
C -4.323770 -0.748887 -0.412292
C -6.835955 -0.702507 0.062835
C -3.040252 0.086551 -0.432519
C 1.737389 -0.245565 0.053738
C 2.094449 1.088484 -0.207876
C 4.221294 0.175506 0.166175
C 3.495883 1.326154 -0.144216
C 0.417965 -0.841366 0.074331
H -5.293792 0.105761 1.357162
H -5.524058 1.033488 -0.144042
H -4.162269 -1.732406 0.071951
H -4.595858 -0.954294 -1.468780
H -6.822523 -1.715231 0.501601
H -7.050860 -0.797925 -1.025076
H -1.978194 -1.675425 0.057998
H 1.343284 1.847358 -0.434532
H 3.978582 2.289890 -0.313686
H 0.340471 -1.921375 0.307804
H -8.011005 0.902829 0.420131


