%chk=000232695.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232695

0 1
S -0.119873 1.101216 -1.497618
S 0.653049 -1.677169 0.425512
P 1.234988 -0.142671 -0.561649
O 2.074708 0.995832 0.308269
O 2.261675 -0.444785 -1.830388
O -3.977207 -0.937876 -0.344675
O -4.432587 0.577712 1.272052
C 4.292297 0.223419 -0.538543
C 3.405602 0.557933 0.689585
C 3.588786 -0.852836 -1.408171
C 4.515971 1.512689 -1.361298
C 5.618409 -0.393872 -0.030245
C 5.428653 1.339329 -2.570753
C 6.433149 0.528998 0.870053
C -1.790533 0.296238 -1.248238
C -2.266359 0.621787 0.160653
C -2.629339 0.927276 -2.338781
C -3.660194 0.133794 0.455784
C -5.253082 -1.616896 -0.109748
C -5.169371 -2.491553 1.134962
C -4.113642 -3.595551 0.996132
C -3.982673 -4.416041 2.275777
H 3.775334 1.451480 1.232910
H 3.332049 -0.282583 1.406292
H 3.533130 -1.840654 -0.911746
H 4.094879 -0.976431 -2.388824
H 3.527835 1.893867 -1.699549
H 4.925843 2.301610 -0.699725
H 5.405943 -1.338052 0.511804
H 6.236578 -0.684879 -0.904820
H 6.437278 1.021855 -2.283886
H 5.527685 2.284274 -3.119414
H 5.030805 0.600382 -3.277620
H 6.649269 1.487653 0.381688
H 7.397570 0.071872 1.125313
H 5.922115 0.746660 1.814331
H -1.720086 -0.811695 -1.392525
H -1.597579 0.160927 0.932790
H -2.227461 1.717267 0.366525
H -2.226289 0.733825 -3.343687
H -2.737865 2.015014 -2.232125
H -3.647707 0.501265 -2.324560
H -5.353285 -2.193554 -1.046731
H -6.045586 -0.852156 -0.029943
H -4.939863 -1.856709 2.017858
H -6.163648 -2.934321 1.341338
H -4.367363 -4.259058 0.146968
H -3.135346 -3.137340 0.738044
H -3.683886 -3.791950 3.126495
H -3.222210 -5.198041 2.165463
H -4.924367 -4.907502 2.543264


%chk=000232695-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232695

0 1
S -0.295131 1.352244 -1.993242
S 0.209627 -1.855935 -0.136074
P 1.015041 -0.126004 -0.935918
O 1.864939 0.907715 0.198013
O 2.279987 -0.341646 -2.131914
O -3.989226 -0.871522 -0.310289
O -4.527498 0.866020 1.152087
C 4.176307 0.107662 -0.494404
C 3.164468 0.324783 0.668040
C 3.545698 -0.868606 -1.528101
C 4.511868 1.482942 -1.145523
C 5.435672 -0.620319 0.079403
C 5.516537 1.444825 -2.316777
C 6.270857 0.182007 1.102354
C -2.017277 0.575753 -1.596385
C -2.455006 0.991136 -0.179197
C -2.962405 1.055891 -2.711460
C -3.763875 0.365463 0.295763
C -5.164389 -1.660647 0.183433
C -4.772842 -2.512998 1.397496
C -3.660443 -3.545254 1.105213
C -3.293667 -4.379820 2.350454
H 3.523460 1.077431 1.387541
H 2.956980 -0.628391 1.197577
H 3.333058 -1.851399 -1.058390
H 4.201713 -1.019091 -2.399597
H 3.566068 1.937958 -1.493171
H 4.900035 2.153852 -0.353762
H 5.110268 -1.571744 0.549596
H 6.090395 -0.909716 -0.766712
H 6.488183 1.006874 -2.021996
H 5.712665 2.470068 -2.679385
H 5.125827 0.868453 -3.174762
H 6.670445 1.113822 0.664574
H 7.132306 -0.420552 1.442872
H 5.685213 0.452450 1.999538
H -1.870604 -0.516415 -1.646547
H -1.683063 0.684900 0.554544
H -2.558502 2.087226 -0.098498
H -2.602529 0.738017 -3.704385
H -3.070377 2.155822 -2.710925
H -3.959673 0.610263 -2.546421
H -5.438599 -2.283176 -0.684681
H -5.978706 -0.956466 0.430004
H -4.467771 -1.843882 2.225116
H -5.687768 -3.039885 1.740964
H -3.993547 -4.219668 0.289617
H -2.762738 -3.018674 0.728419
H -2.920369 -3.731860 3.165638
H -2.503725 -5.117195 2.119000
H -4.171689 -4.932715 2.735855


