%chk=000268562.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268562

0 1
S 0.090455 -1.770581 -1.274365
S 0.994487 0.056509 -1.356546
O -3.020202 1.390001 0.558470
O 4.694727 -0.320889 1.977622
O -1.347614 -3.825480 -0.895562
O -0.789611 0.028441 0.809381
O -3.363390 -3.269289 -1.691855
O 0.059199 1.779455 1.922011
C -3.717129 -0.131558 -1.067045
C 3.871355 0.502964 -0.043086
C -4.100653 0.855464 -0.116051
C 4.965362 -0.087545 0.650288
C -4.731145 -0.775625 -1.782850
C 4.047845 0.808137 -1.399857
C -2.286031 -0.381269 -1.248257
C 2.641698 0.778881 0.693188
C -5.435099 1.200536 0.101013
C 6.171899 -0.388507 0.008801
C -6.074932 -0.437397 -1.576629
C 5.252978 0.517958 -2.048613
C -6.421011 0.542124 -0.645027
C 6.302094 -0.083306 -1.349177
C -1.655603 -1.562312 -1.300728
C 1.385181 0.599587 0.252030
C -3.240608 2.475363 1.493618
C 5.729199 -0.927879 2.791648
C -2.269794 -2.896020 -1.330810
C 0.217590 0.908941 1.092143
H -4.469380 -1.556132 -2.506887
H 3.247495 1.300986 -1.957641
H -1.692097 0.555378 -1.264651
H 2.806106 1.151650 1.722826
H -5.715361 1.955990 0.827178
H 6.995992 -0.850442 0.541996
H -6.849015 -0.949608 -2.145079
H 5.368262 0.759076 -3.103416
H -7.469172 0.800082 -0.489360
H 7.236060 -0.315002 -1.863262
H -2.209642 2.678191 1.836818
H -3.658751 3.341476 0.974472
H -3.875146 2.143750 2.319043
H 5.232869 -0.987385 3.770048
H 5.970532 -1.925966 2.414399
H 6.608495 -0.279248 2.835215
H -1.697260 -4.757064 -0.930038
H -1.645634 0.230666 1.308784


%chk=000268562-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268562

0 1
S -0.179795 -2.100225 -1.829286
S 0.831640 -0.034798 -1.586630
O -3.033090 1.038507 0.908199
O 4.948274 0.494030 2.079572
O -1.940034 -4.137942 -1.938522
O -0.803371 -0.356819 0.917745
O -4.034333 -3.148536 -1.956192
O 0.356688 1.297571 2.068272
C -3.906191 -0.104251 -1.047758
C 3.985200 0.039074 -0.080586
C -4.138263 0.785547 0.053690
C 5.167417 0.167922 0.737205
C -5.018987 -0.411215 -1.877319
C 4.175946 -0.295744 -1.453332
C -2.525082 -0.554328 -1.310935
C 2.695345 0.253065 0.571022
C -5.408173 1.348402 0.298102
C 6.458022 -0.033606 0.195253
C -6.291083 0.150857 -1.644867
C 5.459353 -0.503632 -1.992600
C -6.486043 1.031896 -0.559102
C 6.600177 -0.370257 -1.167967
C -2.006206 -1.773702 -1.668631
C 1.383477 0.148969 0.157431
C -3.129614 2.122626 1.904585
C 6.107357 0.644369 2.963391
C -2.789823 -3.020957 -1.861416
C 0.296449 0.435712 1.149123
H -4.868886 -1.087932 -2.719934
H 3.296070 -0.385720 -2.094807
H -1.764021 0.217977 -1.130755
H 2.785992 0.556912 1.624404
H -5.570238 2.017073 1.147907
H 7.348594 0.067496 0.821603
H -7.123768 -0.098135 -2.310101
H 5.570914 -0.760174 -3.050785
H -7.471770 1.470445 -0.369823
H 7.602425 -0.523479 -1.583418
H -2.118025 2.200196 2.333177
H -3.411394 3.070709 1.413387
H -3.860337 1.864487 2.692777
H 5.682733 0.899143 3.944976
H 6.679656 -0.300099 3.036479
H 6.770569 1.460684 2.618832
H -2.481053 -4.961159 -2.076563
H -1.687116 0.062143 1.188396


