%chk=000265653.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265653

0 1
S -0.552450 1.647662 0.027038
O -0.971494 2.286229 -1.201850
O -0.768253 2.357553 1.264193
O -7.422623 1.167959 0.073400
C 1.007015 0.850845 -0.032730
C 0.397506 -0.466647 0.029602
C -1.016649 -0.068626 0.064827
C 2.342824 1.041106 -0.083691
C 1.146446 -1.604764 0.034762
C 3.181232 -0.150621 -0.065880
C 2.590012 -1.445506 -0.017027
C 2.933239 2.397157 -0.151961
C -2.147744 -0.766513 0.083394
C 0.524888 -2.943553 0.097211
C 4.602486 -0.042692 -0.081804
C 3.440657 -2.590807 -0.016023
C -3.500560 -0.204967 0.043952
C 5.399767 -1.164771 -0.073127
C 4.809839 -2.454456 -0.045417
C 3.601207 2.817652 -1.312684
C 2.802243 3.269800 0.938806
C 0.434870 -3.619894 1.323776
C 0.011362 -3.533066 -1.068270
C -4.516051 -0.826821 0.805854
C -3.819775 0.910585 -0.747629
C 4.142247 4.104067 -1.375161
C 3.351010 4.553372 0.870542
C -0.167113 -4.879463 1.380251
C -0.588126 -4.793553 -1.003415
C 4.021096 4.971021 -0.283719
C -0.678763 -5.467614 0.218800
C -5.812878 -0.337476 0.795181
C -5.121221 1.414988 -0.782534
C -6.104549 0.790811 -0.004731
C -7.840298 2.336836 -0.675261
H -2.100672 -1.866481 0.133825
H 5.055631 0.951092 -0.094831
H 2.985411 -3.582704 0.008780
H 6.484876 -1.077118 -0.085551
H 5.455564 -3.332513 -0.045033
H 3.686419 2.144902 -2.165684
H 2.265322 2.950718 1.834274
H 0.833447 -3.159644 2.226995
H 0.084027 -3.007124 -2.019367
H -4.274291 -1.696569 1.419103
H -3.047754 1.395510 -1.361368
H 4.654625 4.433432 -2.277874
H 3.247264 5.231054 1.717378
H -0.237221 -5.404083 2.332078
H -0.984957 -5.251720 -1.908310
H 4.443147 5.973514 -0.335539
H -1.146130 -6.449348 0.265926
H -6.605012 -0.794274 1.384139
H -5.344866 2.279260 -1.400505
H -7.295288 3.221783 -0.333211
H -8.903831 2.402970 -0.410695
H -7.711709 2.166009 -1.747802


%chk=000265653-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265653

0 1
S -0.521419 1.811718 -0.171321
O -0.918830 2.501402 -1.595572
O -0.774753 2.688161 1.182256
O -7.577941 1.039694 0.049344
C 1.130890 0.801752 -0.120426
C 0.456313 -0.456719 -0.040321
C -0.973029 -0.132939 -0.030121
C 2.489192 1.037998 -0.133056
C 1.213751 -1.638047 0.019055
C 3.297370 -0.175553 -0.013797
C 2.658121 -1.489945 0.026951
C 3.041697 2.418232 -0.244643
C -2.169064 -0.767759 0.082894
C 0.546214 -2.976274 0.083258
C 4.723885 -0.104239 0.097813
C 3.502430 -2.650937 0.077183
C -3.528963 -0.231231 0.035377
C 5.508812 -1.257520 0.180265
C 4.892651 -2.543241 0.143594
C 4.070793 2.731801 -1.174612
C 2.491331 3.462461 0.548970
C 0.641465 -3.786924 1.246162
C -0.218378 -3.447471 -1.017242
C -4.602551 -1.075993 0.457025
C -3.851984 1.078963 -0.425099
C 4.547150 4.053945 -1.297713
C 2.974132 4.782604 0.425291
C -0.013984 -5.036991 1.307771
C -0.867265 -4.701006 -0.958757
C 4.005441 5.083758 -0.493492
C -0.768861 -5.499726 0.204778
C -5.930025 -0.629469 0.454697
C -5.181871 1.536902 -0.435697
C -6.226822 0.686824 0.013482
C -7.945048 2.391860 -0.389346
H -2.099602 -1.857248 0.239584
H 5.200032 0.878759 0.140095
H 3.034847 -3.639538 0.062497
H 6.596847 -1.173595 0.273026
H 5.510964 -3.446555 0.180352
H 4.466775 1.948659 -1.830285
H 1.688911 3.244415 1.263579
H 1.217081 -3.426558 2.106287
H -0.295748 -2.831887 -1.920729
H -4.379322 -2.092713 0.802547
H -3.076477 1.742548 -0.822846
H 5.331049 4.282011 -2.028347
H 2.538528 5.574869 1.043375
H 0.063822 -5.646716 2.214737
H -1.446186 -5.052982 -1.819777
H 4.375450 6.110465 -0.590121
H -1.273992 -6.470819 0.250911
H -6.752314 -1.270555 0.785244
H -5.391872 2.545989 -0.801478
H -7.456005 3.161727 0.237157
H -9.035900 2.445867 -0.263029
H -7.682336 2.552267 -1.452327


