%chk=000236381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236381

0 1
S 1.014130 -1.459603 1.413006
O 1.961636 2.908756 0.828109
O 2.524072 2.174913 -1.210267
C 0.764890 1.006386 0.102037
C -0.360902 1.127200 -0.952261
C -1.611521 0.428743 -0.492024
C 1.375553 -0.347104 0.115921
C 1.840726 2.033927 -0.226421
C 2.227273 -0.930099 -0.776064
C -1.864111 -0.896130 -0.876971
C -2.532860 1.103923 0.323353
C 2.595325 -2.279605 -0.415088
C -3.031121 -1.537039 -0.452002
C -3.697928 0.457966 0.744860
C 2.022415 -2.708776 0.742259
C -3.950034 -0.862195 0.357777
H 0.336195 1.258116 1.115350
H -0.010420 0.713754 -1.922679
H -0.575786 2.197892 -1.154536
H 2.614905 -0.444934 -1.665533
H -1.147505 -1.429403 -1.500096
H -2.343148 2.130850 0.628822
H 3.267744 -2.863928 -1.029657
H -3.222947 -2.566191 -0.751652
H -4.411130 0.984864 1.376699
H 2.128119 -3.661528 1.230994
H -4.858034 -1.363014 0.686812
H 2.660065 3.601861 0.681355


%chk=000236381-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236381

0 1
S 1.031544 -1.302497 1.638194
O 2.324135 2.874859 0.800367
O 2.418941 2.199434 -1.418722
C 0.782883 1.138082 0.116207
C -0.393025 1.273179 -0.919996
C -1.618800 0.474254 -0.511798
C 1.341067 -0.270843 0.187462
C 1.908741 2.091306 -0.281844
C 2.084559 -0.964002 -0.758857
C -1.820965 -0.847167 -0.985326
C -2.576186 1.031165 0.375687
C 2.419095 -2.311244 -0.364362
C -2.950654 -1.594203 -0.582593
C -3.706620 0.287480 0.781834
C 1.935648 -2.656548 0.887778
C -3.897342 -1.029684 0.303024
H 0.420974 1.445698 1.112073
H -0.011783 0.952355 -1.905117
H -0.648974 2.347233 -1.000966
H 2.394953 -0.510801 -1.704153
H -1.086875 -1.291499 -1.667834
H -2.439564 2.056448 0.743715
H 3.001166 -2.995439 -0.986547
H -3.091972 -2.613947 -0.958250
H -4.438891 0.734276 1.463985
H 2.033416 -3.594354 1.431550
H -4.774951 -1.607424 0.614313
H 3.075080 3.463486 0.512277


