%chk=000298222.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298222

0 1
S -1.404282 0.676906 -1.556818
O 2.813500 1.922584 -0.074289
O 4.159710 0.599145 1.203827
O 2.332862 -1.726573 -0.183076
O -0.254003 0.842888 -0.306027
O 0.125577 -1.631974 0.483444
O -0.981887 -0.516017 -2.259613
O -1.450542 1.923788 -2.268939
C 1.906615 1.010325 0.580712
C 2.823634 0.104268 1.440629
C 1.065565 0.342766 -0.526379
C 4.175288 1.421686 0.006152
C 2.806594 -1.397208 1.138394
C 1.053444 -1.203105 -0.511446
C 5.085987 2.599979 0.271224
C 4.501333 0.578721 -1.210543
C -2.809247 0.446243 -0.615544
C -3.983061 1.149853 -0.923630
C -2.790715 -0.436794 0.471047
C -5.134726 0.954702 -0.166789
C -3.942028 -0.634339 1.233934
C -5.123332 0.056930 0.918886
C -6.361904 -0.143495 1.724486
H 1.247831 1.666036 1.199320
H 2.669436 0.282483 2.529433
H 1.443379 0.696353 -1.522035
H 3.838208 -1.806439 1.117800
H 2.184724 -1.945526 1.868250
H 0.822271 -1.662383 -1.502819
H 5.325058 3.144888 -0.649262
H 4.608577 3.312322 0.960704
H 6.024060 2.271426 0.737489
H 5.558252 0.290087 -1.228193
H 3.914459 -0.355136 -1.218432
H 4.277505 1.117207 -2.138910
H 0.078196 -2.613296 0.493266
H -3.993887 1.860843 -1.758327
H -1.860963 -0.967514 0.731456
H -6.044931 1.499892 -0.410817
H -3.919396 -1.322712 2.076812
H -6.666445 0.788818 2.225390
H -7.207337 -0.457392 1.093295
H -6.248480 -0.904634 2.508438


%chk=000298222-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298222

0 1
S -1.116710 -1.399633 -1.303639
O 1.247765 1.091935 0.499920
O 3.484525 0.855649 -0.260826
O 3.633569 -2.296662 -0.025413
O -0.037640 -1.677210 0.247056
O 2.070190 -2.980265 1.687581
O -1.790772 -2.803188 -1.736873
O -0.189840 -0.592938 -2.368915
C 1.785306 -0.203131 0.977650
C 3.320288 0.018958 0.949588
C 1.375884 -1.358913 0.041487
C 2.342456 1.796670 -0.276899
C 4.184544 -1.241529 0.849420
C 2.237879 -2.607870 0.292807
C 2.676876 3.090080 0.477867
C 1.918298 2.010682 -1.727580
C -2.423807 -0.301997 -0.530074
C -2.023868 0.911855 0.054574
C -3.750539 -0.753552 -0.582948
C -3.039585 1.721365 0.604967
C -4.743185 0.083438 -0.024802
C -4.405847 1.325643 0.572132
C -5.475322 2.214979 1.178518
H 1.392608 -0.377863 1.991226
H 3.631002 0.593760 1.848105
H 1.550323 -1.047970 -1.008797
H 5.163137 -0.992666 0.409911
H 4.326294 -1.649585 1.868361
H 1.973241 -3.428443 -0.397179
H 1.768657 3.707622 0.586643
H 3.066275 2.868150 1.486090
H 3.435255 3.668196 -0.078105
H 2.778850 2.377451 -2.313687
H 1.549036 1.072575 -2.170705
H 1.110962 2.761819 -1.780552
H 2.413627 -3.897321 1.830981
H -0.965768 1.197444 0.104263
H -3.995333 -1.717954 -1.038786
H -2.764194 2.672714 1.074816
H -5.790244 -0.237679 -0.053835
H -5.327177 2.326126 2.269147
H -5.445809 3.230527 0.742547
H -6.486310 1.805333 1.016458


