%chk=000222978.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222978

0 1
O 2.979765 -1.000177 -1.509764
O 4.517237 0.447433 0.526511
O -4.263642 0.734320 -0.662323
O -3.925671 -0.319969 1.306647
C 0.347277 0.141646 0.763585
C 1.007669 -0.503212 -0.292851
C 2.398935 -0.403169 -0.398502
C -1.112685 0.035174 0.910607
C 1.082400 0.867696 1.717256
C 3.130778 0.358443 0.539899
C -2.014241 0.391511 -0.020120
C 2.467783 0.986630 1.601650
C -1.706948 0.959138 -1.360449
C -3.459026 0.203733 0.317926
C -5.712920 0.612154 -0.492019
C -6.156662 -0.788955 -0.856517
C 3.958958 -2.027479 -1.187962
C 5.052423 1.121464 -0.646771
H 0.456042 -1.086886 -1.029652
H -1.444704 -0.369327 1.879196
H 0.566827 1.352798 2.545746
H 3.047644 1.558489 2.325913
H -0.676513 1.334936 -1.432999
H -2.382544 1.794403 -1.608579
H -1.842010 0.203325 -2.149318
H -5.969705 0.882645 0.547864
H -6.067579 1.382304 -1.200861
H -7.249404 -0.869123 -0.887256
H -5.769125 -1.093150 -1.837125
H -5.792274 -1.523205 -0.121582
H 4.376316 -2.264957 -2.172081
H 3.442840 -2.889005 -0.755453
H 4.723359 -1.638036 -0.505649
H 6.131387 0.983327 -0.520252
H 4.779568 2.179434 -0.608638
H 4.688046 0.648950 -1.565976


%chk=000222978-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222978

0 1
O 3.206450 -0.479962 -1.676034
O 4.619331 0.196680 0.809963
O -4.389494 0.520180 -0.928629
O -3.851265 0.552423 1.339697
C 0.349459 0.315446 0.606953
C 1.114692 -0.044797 -0.542571
C 2.518646 -0.107725 -0.494186
C -1.113224 0.401887 0.661842
C 1.063836 0.577669 1.817382
C 3.214462 0.230066 0.705290
C -2.059431 0.408101 -0.341170
C 2.468259 0.545768 1.863032
C -1.787407 0.354406 -1.831826
C -3.475178 0.497400 0.137277
C -5.833249 0.589812 -0.555595
C -6.395448 -0.811135 -0.295693
C 3.959422 -1.752824 -1.567501
C 5.351411 1.088215 -0.123349
H 0.640156 -0.323402 -1.484501
H -1.527104 0.492848 1.677207
H 0.499851 0.829376 2.722826
H 3.015133 0.773793 2.783139
H -0.951559 1.021790 -2.108115
H -2.680829 0.655638 -2.396883
H -1.521797 -0.670247 -2.158499
H -5.935396 1.232409 0.336465
H -6.304149 1.069054 -1.429268
H -7.483473 -0.748137 -0.107007
H -6.233316 -1.468480 -1.167478
H -5.918006 -1.264290 0.589046
H 4.456384 -1.882755 -2.540782
H 3.261663 -2.591776 -1.385206
H 4.706209 -1.705256 -0.754089
H 6.417220 0.883050 0.057247
H 5.124680 2.144463 0.113577
H 5.082660 0.873615 -1.172462


