%chk=000298224.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298224

0 1
S -2.513514 1.519182 0.351101
S -2.475188 -1.325073 0.605403
O 2.957389 -1.866451 -0.490555
O 0.514976 -0.800398 -1.714327
O -0.252016 -0.441761 1.746791
O 2.560821 1.510648 0.415346
C 0.711972 -1.004082 -0.302183
C -0.200315 0.037214 0.390817
C 2.192611 -0.778508 0.079119
C -1.606382 0.049202 -0.195433
C 2.810814 0.472086 -0.564689
C -1.843894 2.845479 -0.716945
C -3.902281 -1.582975 -0.510584
C 3.149340 -2.986184 0.396115
C -2.557386 4.115929 -0.307536
C -4.687358 -2.734719 0.080194
C 3.207652 2.756762 0.101422
H 0.394530 -2.042236 -0.048454
H 0.278819 1.048984 0.379695
H 2.297764 -0.736986 1.189790
H -1.582937 -0.042641 -1.306788
H 3.895916 0.340565 -0.718959
H 2.319662 0.747150 -1.515106
H 1.125885 -1.396851 -2.207057
H -0.738783 0.199711 2.315215
H -0.750486 2.928412 -0.578377
H -2.024655 2.599459 -1.778923
H -4.510800 -0.660680 -0.566190
H -3.548511 -1.810611 -1.531810
H 3.716274 -3.688556 -0.227237
H 2.188020 -3.415763 0.693204
H 3.733686 -2.682365 1.270046
H -3.645906 4.043821 -0.443832
H -2.379626 4.371494 0.746730
H -2.214755 4.969885 -0.907741
H -4.093137 -3.657296 0.139424
H -5.047390 -2.513505 1.095248
H -5.571802 -2.959988 -0.531278
H 2.903724 3.399722 0.937195
H 2.840608 3.154419 -0.848916
H 4.294661 2.633405 0.086064


%chk=000298224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298224

0 1
S -2.576415 1.520263 0.794148
S -2.392582 -1.536211 0.672801
O 2.935766 -1.983096 -0.476526
O 0.505774 -0.947530 -1.594346
O 0.029855 -0.026971 1.934648
O 2.546521 1.620919 0.169384
C 0.749717 -0.962776 -0.143188
C -0.115114 0.141152 0.484114
C 2.261394 -0.804548 0.134140
C -1.588784 0.051331 0.061000
C 2.939503 0.396862 -0.540557
C -1.905321 2.945149 -0.285128
C -3.753518 -1.640352 -0.651031
C 3.017180 -3.138201 0.424033
C -2.825009 4.166989 -0.141871
C -4.728939 -2.770267 -0.295019
C 3.226137 2.796312 -0.371274
H 0.417681 -1.931884 0.285013
H 0.285129 1.126051 0.170260
H 2.433986 -0.764510 1.227567
H -1.672414 0.087116 -1.037375
H 4.038677 0.252923 -0.480137
H 2.641147 0.456579 -1.609131
H 1.141931 -1.605338 -1.981587
H -0.602611 0.614377 2.359469
H -0.876043 3.175707 0.037767
H -1.881107 2.576954 -1.325993
H -4.259307 -0.659294 -0.666218
H -3.261174 -1.816075 -1.623021
H 3.522154 -3.933427 -0.147175
H 2.015504 -3.492618 0.740668
H 3.612949 -2.893212 1.326461
H -3.851977 3.933107 -0.473101
H -2.873030 4.513140 0.906264
H -2.444928 5.003371 -0.757947
H -4.214936 -3.747096 -0.244337
H -5.212680 -2.584516 0.680185
H -5.521534 -2.843323 -1.062844
H 2.890258 3.655250 0.231037
H 2.964543 2.965161 -1.437920
H 4.329618 2.698434 -0.287234


