%chk=000232640.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232640

0 1
I 5.415929 0.604197 1.481955
S 2.833673 -0.021916 -0.476295
O 3.371220 -1.318323 -0.837978
O 3.093858 1.140986 -1.297919
O -3.782271 1.517016 0.099164
N -3.043703 -0.668409 0.194748
C 1.123054 -0.186117 -0.269495
C 0.289692 0.935391 -0.350422
C 0.563009 -1.453077 -0.070772
C -1.645883 -0.462431 0.028503
C -1.087861 0.811481 -0.192712
C -0.811207 -1.604508 0.086469
C 3.337222 0.349559 1.191976
C -4.048866 0.341646 0.210882
C -5.437009 -0.202188 0.382361
H 0.719595 1.924826 -0.550737
H 1.210732 -2.339091 -0.047812
H -1.731167 1.697568 -0.250811
H -1.229905 -2.595351 0.241222
H 3.031028 -0.444378 1.894095
H 2.868059 1.278971 1.558249
H -3.339381 -1.642379 0.305243
H -5.735084 -0.870025 -0.437989
H -6.164846 0.629235 0.391678
H -5.568490 -0.745284 1.328196


%chk=000232640-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232640

0 1
I 5.663474 0.566300 1.490068
S 2.927273 -0.026806 -0.503582
O 3.487184 -1.505870 -0.909025
O 3.215240 1.301755 -1.404828
O -3.930102 1.571110 0.033651
N -3.103649 -0.621953 0.189108
C 1.053737 -0.177306 -0.250749
C 0.263334 0.978754 -0.344882
C 0.520426 -1.460335 -0.044905
C -1.707711 -0.422769 0.034165
C -1.133876 0.860287 -0.196102
C -0.873874 -1.576258 0.100576
C 3.524790 0.357440 1.339291
C -4.133596 0.334006 0.182353
C -5.525153 -0.264409 0.372779
H 0.722052 1.949612 -0.561060
H 1.174996 -2.338047 -0.031973
H -1.784606 1.733629 -0.261541
H -1.318872 -2.566263 0.258676
H 3.189239 -0.503855 1.932900
H 3.036405 1.304853 1.605721
H -3.396637 -1.593444 0.321738
H -5.771693 -0.974257 -0.438191
H -6.261216 0.551698 0.361252
H -5.605768 -0.800475 1.336360


