%chk=000262365.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262365

0 1
S -0.020613 -1.209238 1.506683
O -1.057985 3.507644 0.240755
O 5.766135 -0.948767 -0.909553
O -5.802094 -0.975712 -0.909428
O 4.906040 -2.557456 0.256692
O -4.910321 -2.594860 0.216399
N -0.016969 1.470570 0.130478
N 4.853863 -1.470129 -0.290719
N -4.878474 -1.492300 -0.303835
C 1.208697 0.729021 0.013503
C -1.255579 0.738980 0.013196
C 1.325536 -0.544440 0.606950
C -1.356373 -0.546249 0.587200
C 2.287033 1.254640 -0.725424
C -2.358046 1.287356 -0.666432
C 2.502683 -1.277559 0.507417
C -2.525787 -1.289203 0.481264
C -0.038534 2.890293 0.436511
C 3.583458 -0.718109 -0.193904
C -3.621087 -0.722420 -0.191855
C 3.475526 0.535042 -0.819654
C -3.542235 0.559240 -0.760875
C 1.206493 3.474480 1.015359
H 2.191689 2.210242 -1.242603
H -2.297708 2.292868 -1.100802
H 2.602909 -2.273037 0.963676
H -2.612024 -2.296515 0.912364
H 4.328344 0.933022 -1.385162
H -4.414191 0.977652 -1.280645
H 1.862514 3.898338 0.238828
H 1.806003 2.772709 1.613878
H 0.942500 4.316996 1.682938


%chk=000262365-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262365

0 1
S -0.024002 -1.174316 1.700790
O -1.129639 3.516652 0.520202
O 5.799590 -0.963734 -1.056043
O -5.845121 -0.966550 -1.046214
O 4.942575 -2.608973 0.274722
O -4.951525 -2.637814 0.225531
N -0.016938 1.480065 0.205391
N 4.856545 -1.477733 -0.340157
N -4.886777 -1.486907 -0.356263
C 1.208669 0.741843 0.052512
C -1.252140 0.749617 0.033243
C 1.352509 -0.522819 0.685258
C -1.387534 -0.519525 0.657328
C 2.255688 1.230000 -0.769843
C -2.320492 1.266277 -0.740056
C 2.543349 -1.259782 0.557416
C -2.570702 -1.266184 0.527303
C -0.050906 2.870960 0.563797
C 3.589357 -0.714265 -0.215413
C -3.627308 -0.712660 -0.225397
C 3.460922 0.517430 -0.893240
C -3.519334 0.540860 -0.863284
C 1.241994 3.506535 1.056614
H 2.117216 2.169116 -1.312809
H -2.215016 2.241005 -1.216795
H 2.674706 -2.233859 1.035808
H -2.691328 -2.248285 0.991392
H 4.286075 0.883096 -1.508777
H -4.362003 0.924662 -1.442952
H 1.764203 4.026174 0.233448
H 1.941049 2.790012 1.514267
H 0.957723 4.272201 1.795422


