%chk=000247536.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247536

0 1
S -2.296808 3.251518 -0.453283
O -1.288561 -1.117892 -1.204032
O -2.256020 1.941481 0.637711
O -0.078598 0.765345 -0.504467
O -0.866916 0.066662 2.092378
O -1.638175 -2.512148 2.187004
O 0.144509 -3.529070 -1.535672
O -3.263275 4.160582 0.079373
O -2.480180 2.650489 -1.754913
C -2.088343 -0.250346 1.434688
C -2.353350 0.605632 0.173018
C -2.020274 -1.754226 1.046763
C -0.967631 -1.964363 -0.063217
C -1.346470 0.275130 -0.963606
C -0.974822 -3.377736 -0.654360
C 1.075586 0.407446 -1.322567
C 2.122807 -0.099410 -0.369750
C -0.682644 3.836114 -0.259269
C 2.738151 0.788776 0.524937
C 2.485694 -1.454045 -0.370147
C 3.716682 0.324719 1.407973
C 3.468721 -1.911591 0.511835
C 4.085421 -1.024617 1.400040
H -2.856528 -0.060879 2.221608
H -3.389050 0.433504 -0.212968
H -3.015783 -2.164172 0.770017
H 0.049458 -1.686048 0.298482
H -1.604734 0.696825 -1.965737
H -1.909744 -3.598926 -1.198313
H -0.799632 -4.137171 0.135444
H -0.176963 0.371109 1.432870
H -0.928913 -2.024098 2.692913
H 1.371675 1.347257 -1.823351
H 0.787298 -0.341492 -2.083051
H 0.007787 -2.964416 -2.330443
H -0.544065 4.460989 0.638699
H 0.044955 3.002328 -0.148895
H -0.318993 4.438377 -1.104522
H 2.450130 1.838027 0.535227
H 1.996220 -2.162961 -1.046112
H 4.191765 1.014546 2.103981
H 3.750007 -2.964606 0.507859
H 4.849905 -1.384642 2.087054


%chk=000247536-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247536

0 1
S -2.407420 3.366709 -0.943070
O -1.160021 -1.150821 -1.188253
O -1.825699 2.191504 0.414881
O 0.376954 0.446652 -0.229594
O -0.825369 0.139480 2.188127
O -2.053313 -2.296216 2.302678
O -0.232027 -3.801972 -1.397631
O -3.853848 2.845814 -1.458707
O -1.222549 3.625891 -2.015442
C -2.033288 -0.029992 1.370045
C -2.005470 0.778034 0.055980
C -2.194855 -1.550134 1.054637
C -1.123663 -2.011061 0.041259
C -0.900449 0.259378 -0.894932
C -1.315579 -3.435716 -0.474129
C 1.574336 0.289233 -1.126760
C 2.689757 -0.382017 -0.361493
C -2.571118 4.842191 0.234348
C 3.706202 0.395239 0.248276
C 2.729326 -1.796262 -0.237295
C 4.746173 -0.225870 0.975794
C 3.768315 -2.417130 0.490013
C 4.778323 -1.634270 1.098113
H -2.874051 0.303713 2.001273
H -2.978110 0.643364 -0.461412
H -3.210698 -1.763262 0.675471
H -0.121319 -1.914939 0.501135
H -0.923770 0.759911 -1.880099
H -2.305026 -3.531969 -0.968688
H -1.258625 -4.144676 0.365655
H -0.058037 0.331879 1.571356
H -1.333598 -1.824385 2.811630
H 1.853185 1.304875 -1.461223
H 1.264923 -0.320141 -1.996090
H -0.265447 -3.153014 -2.147623
H -3.341812 4.560189 0.962478
H -1.582391 4.963264 0.695629
H -2.860081 5.699142 -0.389482
H 3.681502 1.487898 0.153643
H 1.953955 -2.415073 -0.708633
H 5.527870 0.383723 1.442287
H 3.791798 -3.508792 0.577540
H 5.585311 -2.118371 1.659511


