%chk=000253680.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253680

0 1
O -3.279200 -0.571184 -0.229718
O 6.309901 1.735470 0.596765
O 4.900182 -2.882478 -0.306750
O 2.786701 -2.823673 -1.021762
O -2.491862 1.495366 0.466583
N 4.051858 1.903200 0.640085
N -1.082825 -0.301163 -0.106056
C 2.624519 -0.001230 0.064852
C 2.768176 1.351890 0.466738
C 3.834813 -0.784853 -0.138824
C 1.323363 -0.518290 -0.118644
C 0.206745 0.285549 0.101796
C 1.620284 2.159516 0.692828
C 0.357658 1.637468 0.515518
C 5.061753 -0.239487 0.028748
C 5.250012 1.164280 0.429709
C 3.720060 -2.219872 -0.545225
C -2.294617 0.363578 0.094798
C -4.652417 -0.279109 -0.154379
C -5.424420 -1.330308 -0.675648
C -5.207404 0.881096 0.382294
C -6.811796 -1.195080 -0.646347
C -6.603315 0.987009 0.395465
C -7.402057 -0.040735 -0.113067
H 1.206405 -1.558963 -0.448023
H 1.740985 3.197330 1.007057
H 4.138534 2.882480 0.927725
H -0.530135 2.261351 0.690787
H 5.989523 -0.810030 -0.112392
H -1.113762 -1.274919 -0.430949
H -4.941701 -2.214720 -1.084232
H -4.581977 1.686057 0.776083
H -7.439526 -1.993510 -1.042359
H -7.065708 1.884018 0.808641
H 4.855789 -3.844207 -0.574501
H -8.486042 0.053754 -0.096494


%chk=000253680-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253680

0 1
O -3.293038 -0.518125 -0.173589
O 6.466207 1.647483 0.650493
O 5.008634 -2.838947 -0.738451
O 2.702605 -2.904093 -0.797767
O -2.514697 1.631434 0.509275
N 4.136771 1.841825 0.683456
N -1.088719 -0.184149 -0.013758
C 2.643082 -0.011020 0.095943
C 2.839187 1.349722 0.516774
C 3.846439 -0.817212 -0.137070
C 1.309919 -0.476506 -0.065011
C 0.206730 0.366626 0.178467
C 1.721024 2.188307 0.761219
C 0.414261 1.714267 0.597632
C 5.107444 -0.271767 0.044961
C 5.327102 1.113146 0.473087
C 3.750581 -2.246839 -0.577838
C -2.309081 0.448500 0.150006
C -4.701377 -0.282269 -0.147328
C -5.458323 -1.412939 -0.528795
C -5.322975 0.935179 0.214497
C -6.865619 -1.327463 -0.550455
C -6.735910 0.997916 0.185459
C -7.511839 -0.120114 -0.193059
H 1.159083 -1.511060 -0.385997
H 1.882957 3.223624 1.082873
H 4.266947 2.813536 0.984075
H -0.444675 2.361225 0.785181
H 6.005095 -0.867738 -0.128119
H -1.143683 -1.159426 -0.316417
H -4.937441 -2.335667 -0.801459
H -4.725433 1.799092 0.506233
H -7.454237 -2.202517 -0.846193
H -7.227458 1.936646 0.463790
H 4.883663 -3.781396 -1.030998
H -8.604728 -0.053682 -0.210018


