%chk=000276623.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276623

0 1
S -0.955137 1.858176 -0.406061
S 0.628146 0.613515 -0.988836
O -1.257910 2.730122 -1.507015
O -0.534438 2.408542 0.860305
C -2.198868 0.698672 -0.204675
C 2.090346 1.432201 -0.245212
C 3.089801 0.341899 -0.057889
C -2.335281 0.016172 1.011190
C -3.084576 0.430914 -1.257064
C -4.227392 -1.211287 0.115746
C -3.342623 -0.933416 1.173313
C -4.092920 -0.518201 -1.101020
C 3.935210 -0.030475 -1.115970
C 3.191940 -0.317461 1.177889
C -5.312345 -2.219134 0.289202
C 4.872661 -1.050414 -0.935766
C 4.132431 -1.335891 1.351207
C 4.974153 -1.703898 0.296652
H 1.807404 1.929196 0.709999
H 2.447602 2.228804 -0.927540
H -1.653596 0.231741 1.842102
H -2.990017 0.973664 -2.205669
H -3.443550 -1.460005 2.120811
H -4.777634 -0.721649 -1.922717
H 3.857671 0.470835 -2.079757
H 2.535896 -0.037642 2.000965
H -5.577479 -2.720303 -0.652701
H -5.045585 -3.008652 1.006093
H -6.230636 -1.740840 0.666658
H 5.525387 -1.337146 -1.758823
H 4.208979 -1.844392 2.310911
H 5.705861 -2.497251 0.434371


%chk=000276623-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276623

0 1
S -0.853431 2.247143 -0.544611
S 0.844881 1.421017 -2.140257
O -1.772565 3.429222 -1.184893
O -0.000737 2.531023 0.829126
C -1.971888 0.755446 -0.267699
C 2.313421 1.721269 -0.965706
C 2.838531 0.464107 -0.316412
C -1.445091 -0.380951 0.365616
C -3.300904 0.859915 -0.705382
C -3.676501 -1.419572 0.163211
C -2.317619 -1.470148 0.577265
C -4.150263 -0.246032 -0.479708
C 3.705743 -0.412226 -1.020072
C 2.477627 0.146790 1.020154
C -4.606772 -2.589094 0.424965
C 4.199053 -1.583666 -0.404764
C 2.974388 -1.023828 1.637307
C 3.834314 -1.893662 0.926726
H 1.928408 2.436493 -0.209847
H 3.062858 2.236518 -1.590469
H -0.397077 -0.427396 0.678492
H -3.653402 1.772113 -1.197011
H -1.933860 -2.372929 1.065759
H -5.193568 -0.193242 -0.810843
H 3.993087 -0.174691 -2.051904
H 1.819833 0.829967 1.571419
H -5.418285 -2.638629 -0.321200
H -4.065191 -3.550665 0.408683
H -5.080902 -2.495943 1.421224
H 4.869445 -2.250719 -0.958416
H 2.698622 -1.251601 2.673425
H 4.221348 -2.799636 1.406523


