%chk=000253305.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253305

0 1
S 0.476542 0.208490 0.297139
S -0.943504 -0.843221 2.505899
O 3.658225 1.069028 0.856608
O -2.157389 0.929895 -1.454608
O 3.174689 -1.108896 1.098204
O -1.643503 -1.216544 -1.062384
N 3.721584 -0.847058 -1.857033
N -4.219252 0.305473 0.395926
C 2.798645 0.015466 -1.084520
C -2.762013 0.163895 0.698053
C 1.310677 -0.323532 -1.225827
C -2.558971 -0.973209 1.698936
C 0.214301 -1.328388 1.224764
C 3.199722 -0.130928 0.387002
C -2.105662 -0.182887 -0.642805
H 2.982860 1.085088 -1.397223
H -2.297384 1.119001 1.077172
H 0.854606 0.213527 -2.077880
H 1.129421 -1.399440 -1.413668
H -3.315267 -0.940172 2.511319
H -2.692485 -1.962218 1.209210
H -0.165696 -2.142268 0.575848
H 1.161118 -1.685296 1.694148
H 3.570458 -0.744870 -2.855491
H 3.609906 -1.829994 -1.616913
H -4.375646 1.085476 -0.242318
H -4.746678 0.490396 1.244244
H 3.926244 1.032447 1.815316
H -1.799450 0.763739 -2.363419


%chk=000253305-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253305

0 1
S 0.521121 0.497369 0.100803
S -1.041418 -0.598408 2.545555
O 4.574051 0.516909 0.900900
O -3.304053 0.369924 -1.764350
O 3.307386 -1.430450 0.966904
O -2.250109 -1.543091 -0.993859
N 3.963387 -0.471922 -2.059678
N -4.540672 0.499727 0.689549
C 3.119305 0.106440 -0.995850
C -3.101756 0.158008 0.627970
C 1.648897 -0.285068 -1.213932
C -2.750650 -0.831281 1.765017
C 0.095658 -1.049438 1.136841
C 3.608417 -0.358761 0.388372
C -2.818492 -0.459600 -0.745372
H 3.219346 1.203536 -1.037236
H -2.425317 1.043967 0.704094
H 1.317207 0.068989 -2.201578
H 1.514926 -1.379404 -1.156243
H -3.437942 -0.667925 2.611795
H -2.850357 -1.874890 1.428386
H -0.399769 -1.783891 0.484557
H 1.026652 -1.445838 1.566338
H 4.885966 -0.041400 -2.163755
H 3.989367 -1.496274 -2.073957
H -4.892513 0.943678 -0.164665
H -4.796705 1.014434 1.537607
H 4.928181 0.157994 1.760134
H -3.104015 -0.040331 -2.648650


