%chk=000227874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227874

0 1
O -1.695844 -0.196462 0.267165
O 0.393745 -0.998678 -0.253269
C 0.023320 1.388311 -0.336834
C 0.265271 1.596486 1.172797
C 1.318331 1.590440 -1.164965
C -0.577876 -0.027319 -0.623258
C 1.445257 0.766527 1.692195
C -1.043839 2.395322 -0.817104
C 2.598617 1.304822 -0.437809
C 2.668207 0.952444 0.849126
C -2.909737 -0.731123 -0.317124
C 0.011560 -2.385125 -0.458341
C -3.736385 -1.178579 0.875871
C 1.284900 -3.160236 -0.168443
H -0.655479 1.321298 1.727129
H 0.451571 2.668401 1.369475
H 1.360424 2.640229 -1.526293
H 1.280830 0.960506 -2.077341
H -0.880259 -0.170181 -1.678130
H -0.739043 3.425792 -0.605448
H -1.229300 2.323182 -1.891887
H -1.996476 2.226283 -0.297401
H 1.165996 -0.316330 1.662483
H 1.646307 1.013307 2.749976
H 3.492739 1.414345 -1.049067
H 3.616761 0.755044 1.342186
H -3.394272 0.085241 -0.882024
H -2.671279 -1.565011 -0.997935
H -0.800048 -2.620294 0.253021
H -0.336268 -2.518585 -1.496246
H -4.716524 -1.557545 0.571150
H -3.219534 -1.964369 1.442856
H -3.890837 -0.346370 1.577231
H 1.137837 -4.237723 -0.286297
H 2.098876 -2.843734 -0.834747
H 1.634052 -2.968217 0.855700


%chk=000227874-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227874

0 1
O -1.683827 -0.331386 0.409732
O 0.511870 -1.056525 -0.220548
C 0.007270 1.348923 -0.274719
C 0.289150 1.653832 1.226729
C 1.291633 1.571062 -1.138826
C -0.534687 -0.095145 -0.483847
C 1.528334 0.937527 1.810107
C -1.108460 2.307701 -0.774032
C 2.611694 1.336243 -0.428040
C 2.728318 1.057522 0.894797
C -2.915307 -0.792442 -0.259517
C 0.133394 -2.448439 -0.526989
C -3.966912 -1.004454 0.829580
C 1.385773 -3.309322 -0.367658
H -0.612191 1.399133 1.813989
H 0.444741 2.748380 1.314227
H 1.281732 2.612409 -1.527613
H 1.247032 0.922344 -2.039476
H -0.883867 -0.216204 -1.541742
H -0.792322 3.358311 -0.641184
H -1.323347 2.156092 -1.850445
H -2.043165 2.157317 -0.204386
H 1.300876 -0.135083 1.965772
H 1.764191 1.363145 2.806489
H 3.514608 1.404169 -1.052736
H 3.723989 0.886037 1.328401
H -3.257765 -0.029871 -0.991637
H -2.724961 -1.737689 -0.812213
H -0.667528 -2.772581 0.167816
H -0.260763 -2.500680 -1.568232
H -4.919793 -1.347684 0.386457
H -3.624234 -1.760628 1.557030
H -4.152205 -0.063216 1.375517
H 1.156659 -4.369143 -0.583585
H 2.180039 -2.970497 -1.054733
H 1.771632 -3.237057 0.663913


