%chk=000262779.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262779

0 1
S -0.803194 -0.982447 0.944659
O -3.456455 -1.488775 0.026918
O -3.807195 0.656741 0.234746
O -3.317054 -0.562930 2.140848
C 0.533247 -0.232711 -0.104512
C 0.107453 -0.194443 -1.557328
C 0.601077 1.158854 0.501572
C 1.773285 -1.071538 0.129562
C -1.290314 -2.552419 0.165962
C 1.067205 -0.337081 -2.574817
C 0.652121 2.296799 -0.319144
C 1.848755 -2.368764 -0.413466
C -1.229852 0.039205 -1.914029
C 0.612144 1.326138 1.898710
C 2.862412 -0.592230 0.872026
C -2.769852 -2.699006 0.469892
C 0.690256 -0.287472 -3.918644
C 0.698754 3.575474 0.243143
C 2.963673 -3.174999 -0.182691
C -1.603730 0.085475 -3.260304
C 0.652106 2.607182 2.455669
C 3.980144 -1.402071 1.101423
C -0.648473 -0.082549 -4.266174
C 0.694225 3.735511 1.631380
C 4.032863 -2.697060 0.582930
C -3.468196 -0.459435 0.947905
C -4.025094 1.883839 1.018962
C -2.709980 2.436060 1.512894
H -1.104345 -2.522488 -0.926459
H -0.701292 -3.388117 0.587975
H 2.118491 -0.482503 -2.321973
H 0.657914 2.194406 -1.405895
H 1.041749 -2.748581 -1.039020
H -2.002803 0.193469 -1.150867
H 0.604640 0.462821 2.570555
H 2.860551 0.420730 1.276224
H -3.262724 -3.466964 -0.157405
H -2.983977 -2.880239 1.541811
H 1.442973 -0.405965 -4.696052
H 0.740443 4.448677 -0.406162
H 3.003025 -4.178481 -0.603281
H -2.648239 0.255548 -3.520227
H 0.653053 2.723616 3.538658
H 4.812667 -1.015199 1.687523
H -0.943238 -0.048786 -5.312947
H 0.728205 4.731444 2.068134
H 4.899580 -3.328083 0.767104
H -4.730954 1.652665 1.835481
H -4.505525 2.511282 0.244216
H -2.829137 3.426262 1.965792
H -1.970781 2.525320 0.702275
H -2.255910 1.776218 2.271447


%chk=000262779-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262779

0 1
S -0.634711 -0.833937 1.190667
O -3.581169 -1.662141 0.154197
O -4.619380 0.303605 0.220784
O -4.003368 -0.691646 2.260476
C 0.780287 -0.179129 -0.043394
C 0.238239 -0.119571 -1.486460
C 1.058356 1.244993 0.497278
C 1.983327 -1.133783 0.111434
C -1.247137 -2.425596 0.369923
C 1.118846 -0.280046 -2.589903
C 1.272817 2.331161 -0.389695
C 1.946155 -2.425412 -0.487471
C -1.113914 0.219961 -1.752680
C 1.148950 1.494743 1.894961
C 3.144080 -0.781582 0.847352
C -2.701328 -2.689450 0.773261
C 0.657388 -0.125640 -3.916848
C 1.562156 3.624598 0.101835
C 3.011341 -3.335023 -0.334370
C -1.578402 0.368100 -3.077326
C 1.428475 2.787508 2.386850
C 4.216049 -1.690896 0.998909
C -0.695613 0.195588 -4.168420
C 1.639660 3.861668 1.491809
C 4.155386 -2.975177 0.416148
C -4.053847 -0.677865 1.010412
C -5.137359 1.496423 0.966388
C -4.004269 2.483794 1.253441
H -1.185448 -2.295129 -0.723147
H -0.611147 -3.270633 0.685418
H 2.171533 -0.522986 -2.412290
H 1.209063 2.172231 -1.469879
H 1.085134 -2.714246 -1.098403
H -1.808243 0.350420 -0.916488
H 0.990420 0.673311 2.602442
H 3.222620 0.211500 1.297962
H -3.041891 -3.649713 0.349629
H -2.847347 -2.686372 1.868170
H 1.356883 -0.255225 -4.750591
H 1.722378 4.446062 -0.605719
H 2.952246 -4.321994 -0.807347
H -2.632096 0.612436 -3.251045
H 1.482661 2.953323 3.468703
H 5.100943 -1.388941 1.570769
H -1.056306 0.307629 -5.197165
H 1.857835 4.865897 1.872160
H 4.986068 -3.679646 0.535209
H -5.618042 1.148358 1.897538
H -5.891584 1.912859 0.280205
H -4.414770 3.387804 1.740696
H -3.502586 2.792325 0.320046
H -3.254637 2.037882 1.928566


