%chk=000296939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296939

0 1
S -1.555666 -0.065488 -2.255916
S 2.327897 -0.699790 1.322664
O -1.457419 1.519123 -1.677008
O 2.744779 0.930594 1.178530
O -0.191622 -0.566626 -2.258254
O -2.268596 0.047809 -3.502319
O 0.886461 -0.754214 1.144692
O 2.870985 -1.134436 2.585895
C -0.123957 2.086589 0.243608
C 1.193183 2.728030 0.833310
C -0.854206 3.259114 0.907237
C 0.269662 3.800870 1.423623
C -0.183774 2.053260 -1.276627
C 1.942359 1.904543 1.870259
C -2.285794 3.564064 0.882030
C 0.615518 4.963242 2.246468
C -2.521132 -0.834599 -1.077307
C 3.184455 -1.350441 0.004730
C -3.901491 -0.966152 -1.291023
C 4.498071 -1.811181 0.187363
C -1.950232 -1.330359 0.101808
C 2.591115 -1.426001 -1.262724
C -4.705249 -1.584302 -0.336878
C 5.212378 -2.339332 -0.883595
C -2.751710 -1.949771 1.060897
C 3.304326 -1.954751 -2.338558
C -4.134292 -2.079295 0.851231
C 4.619616 -2.411859 -2.159818
C -4.988285 -2.751816 1.872728
C 5.379624 -2.987305 -3.306677
H -0.369112 1.095482 0.676979
H 1.890789 3.097941 0.061003
H -0.189183 3.069666 -1.719473
H 0.650626 1.465338 -1.706344
H 2.684976 2.525503 2.411476
H 1.267027 1.425741 2.601479
H -2.490466 4.629614 1.050345
H -2.725227 3.282871 -0.091967
H -2.828994 2.994483 1.651771
H 1.425957 5.552242 1.791577
H -0.243680 5.636174 2.383293
H 0.955585 4.660222 3.248313
H -4.349969 -0.585360 -2.216759
H 4.962225 -1.761059 1.179282
H -0.864003 -1.238968 0.283746
H 1.554212 -1.075912 -1.422697
H -5.774578 -1.684760 -0.510494
H 6.229465 -2.696436 -0.735398
H -2.295232 -2.328473 1.975070
H 2.828400 -2.007903 -3.318207
H -4.643438 -2.556536 2.898487
H -6.039462 -2.436735 1.822554
H -4.972520 -3.844488 1.733145
H 6.463406 -2.829760 -3.217444
H 5.216487 -4.074871 -3.373635
H 5.072010 -2.559334 -4.271773


%chk=000296939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296939

0 1
S -1.596858 0.023645 -2.344045
S 2.446529 -0.650354 1.388356
O -1.598591 1.775514 -1.634697
O 2.773656 1.121867 0.913641
O -0.059187 -0.512181 -2.291443
O -2.398668 0.083743 -3.743623
O 0.838682 -0.890462 1.311402
O 3.209724 -0.998782 2.773129
C -0.122172 2.327769 0.270033
C 1.206287 3.005351 0.817353
C -0.876311 3.445641 1.017651
C 0.266976 4.028109 1.505098
C -0.254969 2.278399 -1.253616
C 2.052966 2.132048 1.745289
C -2.344427 3.729633 1.111285
C 0.574215 5.214253 2.371262
C -2.632517 -0.891784 -1.076456
C 3.329644 -1.438372 -0.058912
C -3.989473 -1.089217 -1.377310
C 4.625472 -1.927895 0.173009
C -2.014957 -1.334780 0.104960
C 2.667910 -1.511416 -1.294632
C -4.771876 -1.780755 -0.426389
C 5.291871 -2.538021 -0.911054
C -2.825488 -2.023156 1.033217
C 3.364250 -2.127047 -2.358271
C -4.205755 -2.255674 0.786060
C 4.675054 -2.646825 -2.186330
C -5.048644 -3.020072 1.789666
C 5.391294 -3.330030 -3.335957
H -0.273662 1.311678 0.680514
H 1.850749 3.432125 0.024028
H -0.184926 3.282190 -1.715041
H 0.527499 1.624597 -1.691071
H 2.833442 2.711169 2.273186
H 1.407967 1.632718 2.495574
H -2.551594 4.654411 1.679057
H -2.789488 3.828710 0.102745
H -2.878710 2.893870 1.604047
H 1.244687 5.928588 1.854104
H -0.346719 5.756149 2.651543
H 1.086990 4.917913 3.307783
H -4.411442 -0.725447 -2.319383
H 5.086689 -1.842263 1.161873
H -0.950499 -1.167949 0.310534
H 1.654578 -1.120189 -1.444488
H -5.834835 -1.950694 -0.631319
H 6.304500 -2.930067 -0.763346
H -2.370362 -2.379996 1.963977
H 2.873781 -2.195691 -3.335587
H -4.784196 -2.750940 2.827398
H -6.125846 -2.828324 1.647915
H -4.888945 -4.110643 1.685484
H 6.487255 -3.234051 -3.247953
H 5.155762 -4.411794 -3.355722
H 5.084992 -2.911016 -4.309831


