%chk=000291157.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291157

0 1
S -2.657821 0.489529 -0.994763
O -2.486203 -0.266230 -2.221871
O -2.446124 1.928566 -0.995801
O 3.171466 -0.626384 0.309338
C -4.237591 0.164337 -0.362794
C -1.588426 -0.220025 0.237549
C -4.871248 1.103290 0.457440
C -4.900949 -1.017761 -0.706637
C -0.256790 0.448156 0.190152
C -6.806184 -0.349025 0.638426
C -6.145497 0.848898 0.964197
C -6.175347 -1.281140 -0.204499
C 0.895568 -0.222889 0.111898
C 2.225831 0.458365 0.051205
C -8.175512 -0.618983 1.164659
C 4.516909 -0.324925 0.288836
C 7.288262 -0.028719 0.317626
C 5.067685 0.935552 0.041475
C 5.327958 -1.449921 0.552568
C 6.461976 1.069977 0.058727
C 6.706819 -1.290013 0.564034
C 8.775919 0.115159 0.334748
H -1.493995 -1.317486 0.091570
H -2.006962 -0.119421 1.261097
H -4.370980 2.049447 0.694876
H -4.424776 -1.736788 -1.383345
H -0.291304 1.543910 0.226653
H -6.632344 1.583668 1.602502
H -6.685301 -2.203632 -0.475382
H 0.954293 -1.314888 0.078849
H 2.358999 1.230859 0.829770
H 2.431660 0.876200 -0.953211
H -8.372217 -1.691746 1.299536
H -8.359281 -0.135025 2.133966
H -8.939845 -0.238954 0.467427
H 4.448593 1.801379 -0.163493
H 4.860333 -2.413512 0.738976
H 6.900163 2.048501 -0.134139
H 7.347444 -2.148060 0.764955
H 9.245025 -0.516740 -0.432699
H 9.103533 1.145339 0.146371
H 9.194364 -0.182861 1.306306


%chk=000291157-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291157

0 1
S -2.554156 0.913050 -0.391726
O -1.989417 0.155777 -1.730609
O -2.548171 2.545097 -0.245450
O 3.196712 -0.636273 0.592025
C -4.328958 0.317316 -0.106264
C -1.494946 0.170529 1.174355
C -5.201353 1.150455 0.613246
C -4.718881 -0.910542 -0.663840
C -0.101265 0.647125 1.053787
C -6.972351 -0.534270 0.270088
C -6.529427 0.708165 0.799572
C -6.053338 -1.330786 -0.463328
C 0.872695 -0.072016 0.427392
C 2.265382 0.436616 0.194282
C -8.411945 -0.979368 0.453033
C 4.569284 -0.412673 0.361619
C 7.389389 -0.177280 -0.008946
C 5.113727 0.777050 -0.176573
C 5.425346 -1.484933 0.715905
C 6.514851 0.878970 -0.354406
C 6.813928 -1.361550 0.530347
C 8.891839 -0.061501 -0.203832
H -1.635592 -0.911827 1.034088
H -2.061061 0.567003 2.030024
H -4.857381 2.121479 0.985474
H -4.010958 -1.498938 -1.257303
H 0.118703 1.649303 1.442973
H -7.232597 1.338169 1.356812
H -6.385487 -2.285056 -0.887935
H 0.656830 -1.071834 0.028131
H 2.463042 1.359658 0.776038
H 2.410691 0.661741 -0.885352
H -8.523095 -2.067749 0.310328
H -8.790289 -0.724232 1.458675
H -9.073240 -0.480000 -0.281068
H 4.476662 1.621350 -0.456382
H 4.982526 -2.395964 1.130431
H 6.928548 1.804838 -0.772191
H 7.465828 -2.199253 0.807774
H 9.270835 -0.837215 -0.896104
H 9.170195 0.922157 -0.620098
H 9.434998 -0.186585 0.752106


