%chk=000229123.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229123

0 1
O -1.240605 -0.056537 0.744500
O -1.048738 1.433128 -1.055612
C -3.203292 1.176681 0.048525
C -2.683512 -0.144997 0.660837
C -2.473038 1.447023 -1.277617
C -3.117778 -1.416489 -0.079993
C -4.725014 1.214649 -0.144641
C -0.550573 0.209087 -0.484888
C 0.891027 0.509450 -0.085157
C -2.518030 -2.669231 0.572179
C -5.484826 1.128678 1.176165
C 1.885624 -0.444949 -0.753121
C -2.843769 -3.933430 -0.217641
C 3.293376 -0.117971 -0.330784
C 4.055502 0.802637 -1.066338
C 3.849438 -0.726611 0.804868
C 5.361355 1.104939 -0.671650
C 5.155816 -0.420586 1.194990
C 5.914995 0.493934 0.457986
H -2.906540 1.991034 0.761739
H -2.944377 -0.206607 1.743528
H -2.723867 0.715423 -2.063278
H -2.641227 2.472651 -1.652051
H -2.823831 -1.368771 -1.144808
H -4.223298 -1.483043 -0.080261
H -5.049404 0.397369 -0.818599
H -5.000679 2.155871 -0.663773
H -0.712820 -0.622117 -1.194949
H 0.979039 0.456335 1.022960
H 1.126170 1.566213 -0.343288
H -2.889335 -2.767706 1.611052
H -1.418318 -2.544956 0.661315
H -5.321278 0.169587 1.680919
H -5.179421 1.919856 1.871583
H -6.564617 1.233368 1.017833
H 1.790596 -0.382729 -1.857046
H 1.639233 -1.495133 -0.492372
H -3.924762 -4.092801 -0.300201
H -2.439593 -3.891859 -1.235224
H -2.418615 -4.820565 0.266062
H 3.628459 1.285091 -1.943243
H 3.261962 -1.435123 1.385282
H 5.948711 1.819539 -1.245705
H 5.582892 -0.895598 2.076535
H 6.931664 0.730165 0.762984


%chk=000229123-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229123

0 1
O -1.123915 0.082624 0.659880
O -1.179292 1.946230 -0.879881
C -3.283688 1.220482 0.241775
C -2.603090 -0.134727 0.602973
C -2.640985 1.803924 -1.036572
C -2.972463 -1.335274 -0.300911
C -4.824389 1.143949 0.104680
C -0.577592 0.647348 -0.572954
C 0.918329 0.857162 -0.371848
C -2.221031 -2.631968 0.077034
C -5.545653 0.685697 1.392440
C 1.679460 -0.479876 -0.162180
C -2.625961 -3.827974 -0.810385
C 3.172578 -0.260093 0.030169
C 4.059848 -0.270448 -1.077201
C 3.706740 0.001973 1.318656
C 5.441123 -0.024640 -0.905489
C 5.086872 0.248320 1.496606
C 5.960041 0.236663 0.383826
H -3.036971 1.917686 1.068375
H -2.841721 -0.399191 1.649381
H -2.860583 1.164441 -1.920996
H -3.012580 2.822538 -1.237399
H -2.791538 -1.103875 -1.369858
H -4.062404 -1.514577 -0.205130
H -5.097750 0.473702 -0.734834
H -5.195089 2.151469 -0.174127
H -0.793664 -0.046751 -1.421635
H 1.058191 1.517743 0.502640
H 1.313583 1.389433 -1.256266
H -2.422579 -2.870254 1.141282
H -1.131320 -2.455731 0.005253
H -5.282491 -0.352872 1.665110
H -5.278297 1.334646 2.247261
H -6.642828 0.727436 1.266762
H 1.504668 -1.133839 -1.040151
H 1.242606 -0.988375 0.716499
H -3.708596 -4.041739 -0.726076
H -2.407744 -3.624655 -1.876207
H -2.078218 -4.744421 -0.524302
H 3.664461 -0.476896 -2.080140
H 3.034832 0.008795 2.186211
H 6.111201 -0.040168 -1.772935
H 5.481643 0.445664 2.500027
H 7.030958 0.425317 0.520241


