%chk=000267692.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267692

0 1
S -1.838698 -0.778543 -1.276833
O -0.841494 -0.733047 0.077348
O 4.347437 1.511354 0.745923
O 4.033955 1.468811 -1.553728
O -2.089747 -2.171854 -1.562387
O -1.192522 0.049234 -2.268936
C 1.321469 -0.496279 1.080298
C 2.787705 -1.027733 1.067878
C 0.535774 -1.169198 -0.082208
C 1.305466 1.043811 0.908585
C 3.602885 -0.519313 -0.135624
C 2.823819 -2.568967 1.111966
C 3.508169 1.000772 -0.299157
C 2.073125 1.534326 -0.316758
C 0.560939 -2.700592 -0.023810
C 2.003039 -3.213985 -0.012442
C 0.656025 -0.822648 2.429149
C 4.448208 2.944249 0.854729
C 5.399078 1.125380 -1.856020
C -3.228251 -0.014755 -0.626508
C -3.375301 1.374491 -0.725978
C -4.218894 -0.777994 0.003740
C -4.503345 1.999662 -0.196839
C -5.349164 -0.158363 0.535057
C -5.499547 1.236680 0.438681
C -6.700131 1.904021 1.019360
H 3.286603 -0.635272 1.991339
H 0.907555 -0.791904 -1.063650
H 1.734143 1.512004 1.817111
H 0.252748 1.384653 0.846667
H 4.662667 -0.813820 -0.003261
H 3.262917 -0.994266 -1.076795
H 2.440891 -2.912059 2.093365
H 3.871140 -2.920613 1.060426
H 1.577857 1.204695 -1.256943
H 2.067152 2.638391 -0.370380
H -0.000374 -3.129252 -0.881012
H 0.014941 -3.048361 0.875047
H 2.480649 -3.014634 -0.992067
H 2.005250 -4.314557 0.104440
H -0.405360 -0.539614 2.406932
H 0.694483 -1.894622 2.651282
H 1.132773 -0.293875 3.258780
H 3.559801 3.332076 1.360474
H 4.575279 3.398951 -0.133509
H 5.342699 3.082138 1.471613
H 5.437689 0.099370 -2.231909
H 6.036155 1.252925 -0.974575
H 5.664933 1.839628 -2.643229
H -2.605723 1.972936 -1.228058
H -4.110876 -1.866824 0.074132
H -4.612333 3.079745 -0.277371
H -6.115734 -0.756800 1.024142
H -6.519322 2.183434 2.069772
H -6.970764 2.825953 0.485390
H -7.588939 1.257251 1.009165


%chk=000267692-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267692

0 1
S -1.898122 -1.247443 -1.227629
O -0.882533 -1.293006 0.348693
O 3.987000 1.677549 0.776345
O 3.623918 1.701683 -1.608036
O -2.538355 -2.703888 -1.529161
O -0.990075 -0.505542 -2.355066
C 1.348990 -0.762983 1.200393
C 2.881264 -1.074402 1.012176
C 0.562404 -1.566861 0.112484
C 1.104521 0.770395 1.045336
C 3.487919 -0.411161 -0.256498
C 3.172641 -2.600411 1.021978
C 3.206182 1.098223 -0.336014
C 1.700652 1.389980 -0.235312
C 0.828228 -3.083533 0.126565
C 2.341184 -3.374714 -0.029031
C 0.881773 -1.167074 2.624254
C 3.848272 3.128973 0.949520
C 5.033242 1.491223 -1.969551
C -3.231229 -0.091012 -0.605611
C -3.008213 1.291680 -0.702580
C -4.407250 -0.656418 -0.089932
C -4.032124 2.150712 -0.248920
C -5.413773 0.226834 0.358248
C -5.240148 1.634996 0.293312
C -6.317280 2.571771 0.807412
H 3.395495 -0.612053 1.879206
H 0.822809 -1.160280 -0.887337
H 1.556829 1.269010 1.925911
H 0.016820 0.965055 1.086193
H 4.581006 -0.576876 -0.238044
H 3.096862 -0.870402 -1.183440
H 2.957280 -3.010653 2.027665
H 4.254046 -2.764116 0.843342
H 1.214070 0.989977 -1.143703
H 1.534469 2.482685 -0.251372
H 0.257505 -3.560677 -0.692592
H 0.450849 -3.515450 1.072251
H 2.667737 -3.098838 -1.051497
H 2.521270 -4.461916 0.070548
H -0.179123 -0.896996 2.768923
H 0.978662 -2.248469 2.818895
H 1.483621 -0.632985 3.383237
H 2.886733 3.393386 1.433428
H 3.927890 3.654525 -0.020618
H 4.678488 3.427604 1.609774
H 5.206482 0.464374 -2.346499
H 5.699488 1.686584 -1.107902
H 5.239747 2.211778 -2.777040
H -2.082090 1.679627 -1.138852
H -4.535810 -1.742887 -0.059568
H -3.890994 3.235167 -0.318977
H -6.345788 -0.184648 0.761762
H -6.152239 2.808527 1.876402
H -6.320748 3.528264 0.256813
H -7.321557 2.122305 0.722522


