%chk=000250254.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250254

0 1
S 3.058780 -0.208698 -0.037491
O -1.917809 -0.622629 0.738817
O 1.498432 -0.771841 -0.378518
O 0.485994 1.584683 -1.261404
O -1.311526 2.602055 1.439428
O -3.145156 0.760187 -0.654031
O -0.006104 -3.176522 -0.941398
O 3.307358 -0.473773 1.347758
O 3.075124 1.154682 -0.522436
C 0.387819 -0.243388 0.365613
C 0.192765 1.272201 0.101109
C -0.837546 -1.047130 -0.123191
C -1.264866 1.768639 0.270382
C -2.363065 0.715009 0.540820
C -0.735469 -2.559179 0.123314
C -4.330399 -0.063732 -0.633502
C 3.930185 -1.267673 -1.085365
H 0.571291 -0.427602 1.452171
H 0.862435 1.864982 0.771597
H -1.077808 -0.817030 -1.187348
H -1.542118 2.358091 -0.646122
H -2.961446 0.912069 1.456911
H -1.732484 -3.039979 0.077583
H -0.253138 -2.801213 1.086584
H 1.469813 1.731654 -1.378215
H -1.104062 3.531096 1.203999
H 0.847329 -2.698776 -1.072671
H -5.056898 0.349128 0.071491
H -4.069100 -1.097096 -0.382160
H -4.691296 0.011943 -1.666129
H 4.450536 -2.086261 -0.557622
H 3.289799 -1.768191 -1.835763
H 4.707531 -0.757409 -1.681211


%chk=000250254-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250254

0 1
S 3.066538 0.143878 -0.414843
O -2.049209 -0.662385 0.789268
O 1.467965 -0.918225 -0.293195
O 0.010496 1.351238 -1.472202
O -1.052748 1.942645 2.033661
O -3.017115 0.879626 -0.802666
O 0.166547 -3.269633 -0.676753
O 3.579695 0.680481 1.023987
O 2.854118 1.206626 -1.637787
C 0.307695 -0.307181 0.377652
C 0.080454 1.175635 -0.033071
C -0.936888 -1.149428 -0.046504
C -1.237470 1.706465 0.592408
C -2.430402 0.730078 0.505370
C -0.787785 -2.648529 0.244489
C -4.299282 0.170121 -0.946276
C 4.147846 -1.291065 -1.023691
H 0.425468 -0.369060 1.476750
H 0.914872 1.778060 0.395671
H -1.137665 -0.966753 -1.119677
H -1.512192 2.630255 0.048189
H -3.150719 0.960328 1.314984
H -1.752354 -3.152256 0.070136
H -0.494112 -2.802189 1.304395
H 0.946219 1.370915 -1.827705
H -0.459631 2.725175 2.160720
H 0.977252 -2.687758 -0.683050
H -5.040357 0.543206 -0.209829
H -4.170713 -0.919867 -0.813688
H -4.643803 0.389171 -1.967763
H 4.173092 -2.023019 -0.206148
H 3.655722 -1.675783 -1.926336
H 5.133368 -0.852474 -1.233497


