%chk=000257859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257859

0 1
S -2.408789 2.148357 -0.041579
S 2.004055 1.964714 0.489890
O -2.461751 0.501730 -0.401916
O 2.177318 0.584291 -0.465514
O -3.728195 2.632815 -0.331010
O -1.279089 2.689345 -0.783112
O 3.269800 2.195699 1.129448
O 0.857510 1.704541 1.348365
C -1.221694 -2.145296 0.640799
C 0.802156 -2.919174 -0.040271
C -0.524968 -0.863586 0.081966
C 0.841181 -1.410924 -0.452224
C -0.009589 -2.878206 1.286022
C -1.576386 -3.107821 -0.527448
C -0.193882 -3.638029 -0.993466
C -1.318404 -0.132629 -1.001644
C 2.059260 -0.709036 0.156672
C -2.104389 2.143415 1.651997
C 1.678714 3.102269 -0.748432
H -2.066484 -1.923735 1.302125
H 1.786153 -3.396765 0.015337
H -0.347745 -0.155011 0.928667
H 0.902737 -1.308190 -1.557835
H 0.475026 -2.317679 2.092914
H -0.255281 -3.870779 1.681788
H -2.118435 -2.590778 -1.335564
H -2.228807 -3.922953 -0.181841
H -0.123584 -4.730791 -0.885200
H 0.003169 -3.412022 -2.050492
H -1.781115 -0.832517 -1.730193
H -0.698990 0.605906 -1.545907
H 3.003093 -1.222861 -0.115397
H 1.996315 -0.622038 1.255531
H -2.557189 1.291116 2.182570
H -1.012887 2.072122 1.898433
H -2.458626 3.040522 2.178812
H 2.086110 4.107453 -0.569213
H 2.053474 2.801165 -1.741885
H 0.578308 3.256857 -0.925892


%chk=000257859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257859

0 1
S -2.551218 2.269923 -0.170248
S 2.057540 1.945436 0.644339
O -2.516205 0.388419 -0.188821
O 1.926878 0.634157 -0.672426
O -4.031838 2.738108 -0.598920
O -1.253486 2.825994 -0.985865
O 3.550198 1.971038 1.265787
O 0.808665 1.786550 1.677049
C -1.133605 -2.270868 0.697371
C 0.850058 -3.046403 -0.127761
C -0.498676 -0.999313 0.048778
C 0.818795 -1.557515 -0.616644
C 0.145404 -2.958030 1.259919
C -1.575183 -3.291633 -0.393774
C -0.208323 -3.835622 -0.956319
C -1.365826 -0.197618 -0.925609
C 2.071179 -0.772248 -0.198235
C -2.287362 2.539863 1.688423
C 1.755726 3.371729 -0.560450
H -1.922220 -2.030979 1.428184
H 1.855784 -3.500959 -0.141984
H -0.215033 -0.305953 0.866431
H 0.754005 -1.525835 -1.722374
H 0.683524 -2.339209 2.000530
H -0.050307 -3.951433 1.701653
H -2.209665 -2.836451 -1.173946
H -2.167273 -4.103672 0.065506
H -0.107844 -4.922025 -0.779755
H -0.093680 -3.664146 -2.042157
H -1.802086 -0.812957 -1.734114
H -0.767966 0.614984 -1.386632
H 2.988995 -1.165710 -0.672729
H 2.205085 -0.795310 0.901631
H -3.048387 1.924115 2.185787
H -1.255674 2.208334 1.884949
H -2.434220 3.615564 1.861960
H 1.919357 4.289843 0.021110
H 2.491640 3.241516 -1.364250
H 0.711345 3.249812 -0.891091


