%chk=000179367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179367

0 1
S 2.477389 -0.003895 0.431647
O 2.866295 1.250917 1.047048
O 2.849128 -1.261986 1.051657
O -4.059479 -1.192380 -0.215547
O -4.234113 1.035024 -0.311191
C 0.731798 0.006721 0.248879
C 3.032060 -0.010804 -1.246416
C 0.052249 1.223463 0.173840
C 0.034869 -1.201366 0.210793
C 4.552360 -0.021987 -1.270632
C -2.036169 0.021240 -0.034221
C -1.338190 1.236928 0.026400
C -1.356537 -1.200099 0.064275
C -3.512475 0.071701 -0.196974
H 2.644737 -0.886406 -1.805287
H 2.657716 0.868577 -1.808254
H 0.600276 2.170209 0.248754
H 0.569848 -2.153044 0.313966
H 4.933212 -0.027361 -2.300674
H 4.979007 0.864432 -0.776030
H 4.966107 -0.911941 -0.771471
H -1.884666 2.182760 -0.035435
H -1.916093 -2.139551 0.032688
H -5.051030 -1.171751 -0.318514


%chk=000179367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179367

0 1
S 2.512639 0.000388 0.423586
O 2.928110 1.439122 1.087998
O 2.922003 -1.431451 1.106811
O -4.207288 -1.219646 -0.173879
O -4.316063 1.100539 -0.227966
C 0.619701 0.002293 0.208293
C 3.227677 -0.012880 -1.392930
C -0.035598 1.243706 0.150927
C -0.040632 -1.236877 0.185949
C 4.749353 -0.013524 -1.295988
C -2.142750 0.003564 -0.020738
C -1.440774 1.236623 0.029595
C -1.447120 -1.230586 0.065341
C -3.628039 0.056077 -0.148586
H 2.800489 -0.926326 -1.836660
H 2.802347 0.895090 -1.849512
H 0.534673 2.175060 0.231493
H 0.527267 -2.167175 0.292132
H 5.181552 -0.020316 -2.313679
H 5.113889 0.886692 -0.772039
H 5.112637 -0.907441 -0.760515
H -2.010079 2.170147 -0.019987
H -2.011426 -2.166387 0.044155
H -5.194268 -1.127290 -0.254500


