%chk=000261826.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261826

0 1
S 2.722718 -0.785455 0.363710
S -3.918655 0.092852 0.972829
O 3.640119 -1.734612 -1.908922
O -3.479832 -0.576891 -1.529871
C 0.111515 1.095348 0.772534
C 0.500598 0.478587 -0.586183
C 0.748409 2.491689 0.924321
C 2.006899 0.448689 -0.812115
C 2.273722 2.415759 0.782784
C 2.683138 1.791472 -0.557510
C -1.423692 1.197707 0.913640
C -2.085194 -0.171993 1.026576
C -1.815363 -0.890678 2.331809
C 3.618276 -1.912347 -0.724445
C -4.328983 -0.250393 -0.750902
C 4.264869 -3.000623 0.048763
C -5.780408 -0.074086 -0.999483
H 0.499755 0.440307 1.591944
H 0.070088 -0.539899 -0.677756
H 0.030345 1.062045 -1.406678
H 0.485525 2.924017 1.907443
H 0.333987 3.182506 0.165952
H 2.236280 0.090777 -1.849909
H 2.710272 3.428788 0.869864
H 2.702703 1.830503 1.620425
H 2.413676 2.483864 -1.383597
H 3.785802 1.690619 -0.606182
H -1.835347 1.752606 0.045593
H -1.669233 1.817405 1.799756
H -1.808978 -0.814508 0.150797
H -0.740045 -1.099718 2.443911
H -2.334727 -1.857219 2.388288
H -2.117370 -0.306698 3.211114
H 3.529279 -3.611260 0.597750
H 4.973543 -2.613620 0.799075
H 4.826342 -3.681274 -0.612232
H -6.119990 0.950199 -0.774243
H -6.392219 -0.749717 -0.378935
H -6.033825 -0.279143 -2.052715


%chk=000261826-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261826

0 1
S 2.875895 -0.781294 0.587323
S -4.074479 -0.135511 1.088727
O 3.780420 -1.808006 -1.804400
O -3.536267 0.142042 -1.590455
C 0.044005 1.019056 0.807104
C 0.492098 0.313988 -0.498997
C 0.604920 2.466060 0.849714
C 2.019168 0.354584 -0.709784
C 2.142589 2.500805 0.684588
C 2.583911 1.786441 -0.613443
C -1.500878 1.042601 0.963001
C -2.167757 -0.349675 0.998678
C -1.736336 -1.240795 2.174377
C 3.818875 -1.905018 -0.557316
C -4.428611 0.143085 -0.710881
C 4.642999 -2.937301 0.190693
C -5.902667 0.368820 -0.995814
H 0.483587 0.465818 1.665125
H 0.148178 -0.735757 -0.526853
H 0.016064 0.827880 -1.361283
H 0.314079 2.950390 1.802966
H 0.135007 3.057351 0.035011
H 2.303252 -0.120246 -1.667929
H 2.501406 3.547840 0.677343
H 2.620390 2.004178 1.553488
H 2.198547 2.350609 -1.489441
H 3.685571 1.768389 -0.699977
H -1.931151 1.619147 0.120688
H -1.758473 1.586385 1.894741
H -2.021388 -0.865795 0.033387
H -0.656962 -1.467420 2.098119
H -2.284432 -2.198897 2.173134
H -1.910833 -0.741865 3.145258
H 4.459894 -2.914009 1.276267
H 5.715490 -2.748012 0.000526
H 4.411512 -3.942533 -0.203982
H -6.037477 1.377334 -1.427667
H -6.524874 0.275889 -0.091862
H -6.241275 -0.360955 -1.752972


