%chk=000273642.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273642

0 1
S -0.753078 1.732891 0.782425
S -2.093310 1.141862 -1.782433
S 3.249947 -0.848323 0.975159
S 2.237730 -1.736241 -1.664098
O -3.029523 -0.672613 -0.219816
O 2.098235 2.995765 0.159474
O -1.958392 -1.720639 1.479704
O 2.043356 1.361770 1.701938
C -0.642114 0.739220 -0.750670
C 1.871896 -0.674521 -0.225702
C -0.663053 -0.733025 -0.356259
C 1.873966 0.784092 -0.690097
C 0.591429 -1.109617 0.459219
C 0.616171 1.126947 -1.505932
C -1.904543 -1.100753 0.444472
C 1.976812 1.678477 0.538318
C -1.923052 3.002314 0.187806
C -2.951998 2.308339 -0.666952
C 4.329970 -1.977295 0.025955
C 3.481928 -2.822750 -0.887913
C -4.326421 -1.062649 0.345738
C -4.602547 -2.522664 0.052127
H -0.685253 -1.362396 -1.293284
H 2.779509 0.992862 -1.327919
H 0.526396 -0.655821 1.482988
H 0.587735 -2.203581 0.660907
H 0.621150 2.214576 -1.750257
H 0.660775 0.612280 -2.491805
H -1.373135 3.789903 -0.364148
H -2.370703 3.481652 1.081860
H -3.687720 1.741797 -0.059365
H -3.519250 3.014943 -1.304320
H 4.887664 -2.589087 0.763757
H 5.079080 -1.380139 -0.530262
H 4.071466 -3.285516 -1.704856
H 2.971828 -3.645819 -0.348674
H 2.168832 3.606625 0.941065
H -4.317788 -0.841007 1.427484
H -5.002148 -0.377767 -0.196365
H -5.629956 -2.798648 0.315478
H -4.454003 -2.754160 -1.010425
H -3.928089 -3.176684 0.625778


%chk=000273642-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273642

0 1
S -1.044100 2.059681 0.839662
S -1.825392 1.415300 -2.101341
S 3.451705 -1.080860 0.972697
S 2.174148 -1.476988 -1.819904
O -3.000385 -0.891792 -0.290154
O 2.523625 3.142490 0.414133
O -1.839602 -1.410910 1.655887
O 2.159757 1.473186 1.980988
C -0.578233 0.991042 -0.695591
C 1.973098 -0.546959 -0.151128
C -0.598020 -0.519652 -0.293729
C 2.043097 0.963863 -0.467567
C 0.652976 -0.925041 0.537167
C 0.793107 1.405576 -1.290134
C -1.843829 -0.965143 0.485578
C 2.221109 1.824301 0.784546
C -2.271078 3.193127 -0.045415
C -3.066199 2.338774 -1.033076
C 4.160870 -2.424697 -0.163116
C 3.037178 -2.964302 -1.045857
C -4.262890 -1.369383 0.361324
C -4.414676 -2.883862 0.197103
H -0.587521 -1.088436 -1.245922
H 2.933198 1.157099 -1.095237
H 0.619215 -0.447450 1.533467
H 0.622798 -2.013627 0.714903
H 0.808826 2.499118 -1.424163
H 0.883890 0.951581 -2.297762
H -1.722497 4.000094 -0.556994
H -2.911911 3.616723 0.748235
H -3.707713 1.606635 -0.519740
H -3.664882 2.960127 -1.722448
H 4.562957 -3.208216 0.503051
H 4.971612 -1.990934 -0.769237
H 3.417752 -3.572763 -1.884337
H 2.302421 -3.547214 -0.466807
H 2.612087 3.694281 1.237548
H -4.241494 -1.078980 1.426388
H -5.052819 -0.816583 -0.173141
H -5.390323 -3.208409 0.604424
H -4.372584 -3.169071 -0.868279
H -3.619478 -3.417125 0.744081


