%chk=000251649.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251649

0 1
S -2.924493 0.061354 -1.229419
S 2.924479 0.067255 1.228320
O -2.055844 0.118608 1.704653
O 2.055808 0.112176 -1.705936
O -7.739446 -0.093050 0.019455
O 7.739488 -0.092251 -0.019854
O -6.492553 -1.351835 1.389896
O 6.492612 -1.356795 -1.384998
C -1.326110 0.048861 -0.553467
C 1.326090 0.051500 0.552448
C -4.125958 -0.165726 0.118944
C 4.125944 -0.165561 -0.119066
C -1.121475 0.077263 0.937009
C 1.121449 0.073677 -0.938133
C -0.287657 0.046785 -1.402379
C 0.287639 0.052709 1.401363
C -5.474262 -0.262374 -0.574744
C 5.474287 -0.259026 0.574996
C -6.542728 -0.655201 0.407193
C 6.542771 -0.656016 -0.405244
H -4.081768 0.680364 0.837869
H -3.898224 -1.075384 0.716967
H 3.898307 -1.077833 -0.713131
H 4.081623 0.677393 -0.841660
H -0.401668 0.026411 -2.492852
H 0.401656 0.036932 2.491911
H -5.752029 0.697657 -1.072854
H -5.467417 -1.022479 -1.394333
H 5.751968 0.703201 1.068898
H 5.467559 -1.015540 1.397903
H -8.493159 -0.333505 0.623305
H 8.493212 -0.335268 -0.622664


%chk=000251649-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251649

0 1
S -3.055552 0.600405 -1.157876
S 3.055694 0.606388 1.154657
O -2.016473 0.621716 1.849201
O 2.016601 0.616032 -1.852255
O -7.834460 -1.050304 -0.189761
O 7.834680 -1.047793 0.192289
O -6.323639 -1.540342 1.507108
O 6.322703 -1.548057 -1.500559
C -1.372172 0.518576 -0.499418
C 1.372298 0.521073 0.496689
C -4.219556 -0.119776 0.170563
C 4.219386 -0.119993 -0.170699
C -1.084400 0.562023 0.981260
C 1.084516 0.559132 -0.984134
C -0.325725 0.521111 -1.396438
C 0.325872 0.526305 1.393700
C -5.560337 -0.363857 -0.538661
C 5.560561 -0.360231 0.539082
C -6.557740 -1.037401 0.388159
C 6.557473 -1.038766 -0.384625
H -4.295542 0.597425 0.996436
H -3.780549 -1.051918 0.553939
H 3.780466 -1.054157 -0.549238
H 4.294788 0.593156 -1.000125
H -0.491000 0.495638 -2.478883
H 0.491169 0.504801 2.476226
H -6.007852 0.576838 -0.908634
H -5.433618 -1.016705 -1.424694
H 6.008251 0.582440 0.903765
H 5.434336 -1.008332 1.428667
H -8.469023 -1.515223 0.420947
H 8.468943 -1.515902 -0.416290


