%chk=000233920.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233920

0 1
S -0.117631 0.660047 -0.739149
O 0.454668 -0.600979 -0.276693
O -1.253025 0.557345 -1.643741
O 2.270170 1.070319 0.329683
O -2.542689 0.687355 0.427798
O 4.314527 0.244001 -0.275062
O -3.281195 -1.150809 1.579185
N 2.836987 -0.970854 1.120489
N -3.786452 -0.781143 -0.705741
C 1.095972 1.585170 -1.653947
C -0.460450 1.660842 0.678363
C 2.261999 2.004307 -0.778022
C -1.609934 1.057899 1.473604
C 3.265382 0.061857 0.301618
C -3.208803 -0.541336 0.534248
C 3.630570 -2.222618 1.103066
C -4.280032 -2.148286 -0.983652
H 1.459392 0.966464 -2.505651
H 0.642166 2.457214 -2.164505
H 0.440191 1.747191 1.332270
H -0.710994 2.702002 0.394270
H 3.235777 1.989076 -1.308274
H 2.119756 2.986578 -0.292500
H -1.325138 0.171317 2.073404
H -2.126661 1.794596 2.113265
H 1.808638 -1.101034 1.189409
H -3.372235 -0.272177 -1.507140
H 3.306072 -2.917089 0.309330
H 3.513752 -2.721108 2.081483
H 4.705521 -2.008711 0.954446
H -3.496705 -2.804253 -1.399752
H -5.111562 -2.080475 -1.706642
H -4.668031 -2.620509 -0.060962


%chk=000233920-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233920

0 1
S -0.207987 0.671003 -0.847923
O 0.170928 -0.791910 -0.195114
O -1.351108 0.715499 -2.023571
O 2.420423 1.159813 0.490850
O -2.826753 0.785101 0.638664
O 4.574468 0.349103 -0.077478
O -3.443898 -1.257266 1.674987
N 2.907461 -1.028659 0.889257
N -3.714677 -0.851917 -0.642327
C 1.391071 1.449123 -1.697856
C -0.689790 1.829305 0.671409
C 2.341880 2.060753 -0.668656
C -1.682657 1.046363 1.519416
C 3.430948 0.125136 0.389291
C -3.349326 -0.553623 0.640629
C 3.708453 -2.248854 1.036105
C -4.367260 -2.115890 -0.990725
H 1.805200 0.563210 -2.206277
H 0.968516 2.164224 -2.420731
H 0.265658 2.023573 1.182845
H -1.132315 2.717645 0.195243
H 3.347969 2.201495 -1.109096
H 1.979114 3.027321 -0.283308
H -1.255482 0.098596 1.894693
H -1.998168 1.663805 2.382416
H 1.877462 -1.071601 0.918929
H -3.315540 -0.246337 -1.370341
H 3.374409 -3.028604 0.327180
H 3.628943 -2.644947 2.063931
H 4.762118 -2.008159 0.824260
H -3.693583 -2.762595 -1.583393
H -5.290774 -1.935270 -1.570018
H -4.625699 -2.643238 -0.058790


