%chk=000220039.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220039

0 1
O 6.126065 -0.276034 -0.225695
O 4.986306 1.642490 -0.089876
C -2.514279 -0.484827 0.157606
C -3.098118 0.397029 1.229656
C -4.223076 1.299090 0.700182
C -1.182416 -1.112975 0.483407
C -5.190665 0.501636 -0.183401
C -0.026896 -0.189204 0.068080
C -4.451635 -0.107954 -1.384840
C -3.135062 -0.719091 -1.007514
C 1.335885 -0.814504 0.392666
C 2.481938 0.116660 -0.019267
C 3.845303 -0.512025 0.289407
C 4.961666 0.437787 -0.017447
H -3.486382 -0.247709 2.045561
H -2.305232 1.021282 1.686941
H -4.766189 1.761394 1.544107
H -3.787211 2.133044 0.116649
H -1.082759 -2.092993 -0.025443
H -1.118193 -1.340747 1.565872
H -6.014211 1.149958 -0.532647
H -5.661110 -0.304426 0.411800
H -0.128569 0.789436 0.576642
H -0.099552 0.029257 -1.015724
H -4.271598 0.674691 -2.152083
H -5.094579 -0.868292 -1.871291
H -2.699887 -1.365342 -1.766707
H 1.398432 -1.037833 1.475509
H 1.434271 -1.789543 -0.123220
H 2.412730 0.353842 -1.100091
H 2.392746 1.092632 0.502844
H 3.983736 -1.460548 -0.275767
H 3.910604 -0.804678 1.361622
H 6.906038 0.307099 -0.420039


%chk=000220039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220039

0 1
O 6.313516 -0.291460 0.240342
O 5.070416 1.588593 -0.314170
C -2.555705 -0.487640 0.078702
C -3.042373 0.505242 1.131137
C -4.230005 1.366045 0.641331
C -1.186867 -1.115435 0.303978
C -5.293714 0.485837 -0.052456
C -0.000156 -0.146979 0.039434
C -4.691776 -0.218269 -1.292109
C -3.314600 -0.796990 -1.010367
C 1.373556 -0.807507 0.292469
C 2.556448 0.149531 0.028299
C 3.917193 -0.532068 0.266779
C 5.098969 0.386171 0.026667
H -3.337085 -0.056777 2.044173
H -2.205206 1.161860 1.442855
H -4.675345 1.917577 1.491574
H -3.861255 2.123081 -0.079874
H -1.069931 -2.002257 -0.350147
H -1.110497 -1.479096 1.351738
H -6.171099 1.093022 -0.346843
H -5.653170 -0.279318 0.664676
H -0.095746 0.751087 0.682435
H -0.054982 0.209734 -1.008451
H -4.624363 0.501061 -2.137184
H -5.369872 -1.024028 -1.639173
H -2.918576 -1.513518 -1.746139
H 1.416161 -1.172064 1.340716
H 1.469364 -1.705718 -0.353521
H 2.510849 0.525815 -1.011621
H 2.472701 1.041169 0.678720
H 4.038788 -1.418705 -0.386255
H 3.993899 -0.916369 1.303332
H 7.068565 0.336976 0.076452


