%chk=000227555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227555

0 1
O -1.524126 0.109211 0.073219
O -2.616349 -1.322491 -1.290188
C 3.174927 0.512495 -1.287814
C 2.054335 -0.467362 -0.877095
C 0.772503 0.262176 -0.463001
C 3.696137 1.331361 -0.088162
C -0.293872 -0.722585 0.025632
C 4.303937 -0.262714 -2.001535
C -0.099285 -1.220833 1.457043
C 4.333464 0.485026 1.020611
C -0.332507 -2.735774 1.642851
C 5.301005 0.660087 -2.697838
C 4.804607 1.356054 2.193579
C -1.767824 -3.135089 1.289787
C 0.680224 -3.560002 0.837965
C 5.442270 0.517557 3.299330
C -2.624829 -0.304641 -0.628769
C -3.751457 0.645626 -0.453152
C -4.958285 0.371809 -1.116965
C -3.628407 1.788631 0.350148
C -6.039337 1.244031 -0.974125
C -4.714182 2.656778 0.488457
C -5.917073 2.384701 -0.172488
H 2.744612 1.240781 -2.021734
H 1.832216 -1.151424 -1.719974
H 2.407618 -1.115080 -0.050251
H 0.987405 1.015717 0.320729
H 0.366554 0.841691 -1.317158
H 4.431643 2.073928 -0.455391
H 2.858594 1.922498 0.332592
H -0.461532 -1.550241 -0.701080
H 4.835411 -0.907893 -1.275016
H 3.862849 -0.951691 -2.748952
H 0.917798 -0.964919 1.813705
H -0.789703 -0.660186 2.123224
H 5.188235 -0.088177 0.611055
H 3.609090 -0.271354 1.380810
H -0.169700 -2.957777 2.729734
H 4.810359 1.301479 -3.438522
H 5.811530 1.315320 -1.981996
H 6.072019 0.084065 -3.221712
H 5.529559 2.112063 1.833570
H 3.950684 1.928915 2.604815
H -1.997696 -2.950641 0.229129
H -1.943961 -4.199354 1.474600
H -2.498873 -2.570453 1.876987
H 0.556889 -3.413617 -0.241362
H 1.710505 -3.294451 1.093442
H 0.557403 -4.631551 1.030655
H 6.316082 -0.034012 2.934211
H 5.776468 1.147449 4.131238
H 4.738281 -0.216985 3.706215
H -5.039462 -0.523096 -1.740197
H -2.683167 1.989883 0.860838
H -6.976964 1.035480 -1.487181
H -4.623088 3.545320 1.111071
H -6.762537 3.063861 -0.062783


%chk=000227555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227555

0 1
O -1.539378 -0.165407 0.350538
O -1.970689 -0.402495 -1.932424
C 3.186500 0.437414 -1.332215
C 2.117245 -0.555670 -0.794795
C 0.848386 0.123345 -0.229583
C 3.710516 1.419123 -0.242986
C -0.230981 -0.901551 0.176943
C 4.322980 -0.354419 -2.040415
C 0.037896 -1.600938 1.521701
C 4.409968 0.766018 0.972547
C -0.578517 -3.018320 1.700148
C 5.391990 0.524557 -2.726028
C 4.926014 1.809407 1.991208
C -2.115817 -3.036957 1.521688
C 0.097740 -4.059612 0.774231
C 5.604944 1.168365 3.220839
C -2.308909 0.023511 -0.796454
C -3.568855 0.774875 -0.512993
C -4.443527 1.043328 -1.597933
C -3.904713 1.218441 0.792493
C -5.644112 1.749231 -1.379411
C -5.107800 1.923825 1.006833
C -5.978732 2.190746 -0.076610
H 2.691453 1.060838 -2.110593
H 1.814858 -1.223683 -1.628302
H 2.578459 -1.209167 -0.026846
H 1.096254 0.753061 0.646621
H 0.429372 0.789137 -1.008406
H 4.414036 2.133906 -0.715024
H 2.866213 2.037211 0.124709
H -0.377856 -1.618672 -0.652688
H 4.812856 -1.033438 -1.313076
H 3.857335 -1.011014 -2.803532
H 1.135516 -1.680426 1.653648
H -0.328345 -0.929644 2.323381
H 5.263093 0.144244 0.632624
H 3.709080 0.078749 1.489852
H -0.360092 -3.317002 2.747835
H 4.924237 1.240970 -3.428032
H 5.978935 1.107044 -1.992841
H 6.103234 -0.095891 -3.301999
H 5.640583 2.489574 1.483809
H 4.078241 2.443619 2.322948
H -2.401929 -2.815808 0.476780
H -2.522853 -4.033847 1.775187
H -2.607604 -2.287143 2.167616
H -0.095444 -3.838456 -0.292634
H 1.193908 -4.080476 0.923538
H -0.292700 -5.074504 0.975068
H 6.471164 0.550098 2.917895
H 5.968266 1.934922 3.929957
H 4.899776 0.511841 3.765038
H -4.162334 0.690052 -2.595583
H -3.221275 1.006234 1.619212
H -6.317593 1.955260 -2.218354
H -5.367825 2.265915 2.014540
H -6.912170 2.739280 0.093131


