%chk=000230158.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230158

0 1
O 1.646787 -0.669157 0.330503
O 2.667888 -0.361089 -1.660685
C -2.496917 0.050272 0.201491
C -4.002533 0.115248 -0.168958
C -2.010440 -1.412413 0.299756
C -1.634518 0.800827 -0.836791
C -4.489677 1.577301 -0.267752
C -4.865412 -0.634316 0.869507
C -0.529461 -1.487249 0.685922
C -0.147858 0.756314 -0.469298
C 0.316716 -0.692928 -0.311317
C -5.975974 1.644091 -0.644541
C -6.353807 -0.580128 0.498887
C -6.841225 0.868344 0.357967
C 2.755486 -0.496612 -0.462469
C 3.978359 -0.535491 0.411003
C 5.098096 0.333059 -0.172559
C 6.383416 0.211599 0.653880
C 7.502236 1.088694 0.073884
C 8.788228 0.973347 0.888690
H -2.354726 0.536951 1.196265
H -4.145044 -0.371691 -1.163439
H -2.611931 -1.964820 1.047783
H -2.176948 -1.930086 -0.664350
H -1.787904 0.363636 -1.842247
H -1.961645 1.856038 -0.913698
H -3.892366 2.130179 -1.017286
H -4.324510 2.093233 0.696845
H -4.713183 -0.191974 1.872071
H -4.541246 -1.689225 0.947307
H -0.371277 -1.086574 1.707562
H -0.187856 -2.538363 0.723478
H 0.458594 1.261677 -1.246717
H 0.037617 1.312684 0.470056
H 0.420349 -1.205727 -1.291002
H -6.304327 2.699082 -0.689010
H -6.123626 1.234073 -1.662032
H -6.524379 -1.125990 -0.448803
H -6.950805 -1.105903 1.266933
H -6.812204 1.370319 1.343932
H -7.898812 0.882820 0.036629
H 3.723775 -0.215029 1.444383
H 4.310055 -1.592719 0.505603
H 4.769547 1.390496 -0.216125
H 5.287059 0.037720 -1.226355
H 6.189214 0.499382 1.705179
H 6.716117 -0.843954 0.687298
H 7.174003 2.146271 0.041067
H 7.699019 0.801330 -0.978025
H 8.638641 1.287298 1.927967
H 9.164024 -0.056030 0.907983
H 9.580587 1.602687 0.467530


%chk=000230158-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230158

0 1
O 1.692370 -0.497067 0.631537
O 2.646333 -0.090405 -1.461319
C -2.615598 0.098798 0.320936
C -4.088632 0.099735 -0.206075
C -2.033489 -1.338015 0.436390
C -1.673600 0.961437 -0.565477
C -4.667008 1.538658 -0.317997
C -5.027327 -0.767869 0.680031
C -0.564926 -1.353690 0.929063
C -0.206082 0.948127 -0.070977
C 0.317710 -0.492628 0.021239
C -6.139447 1.560090 -0.794533
C -6.499165 -0.743570 0.202009
C -7.044544 0.698716 0.113846
C 2.773392 -0.288502 -0.229371
C 4.086055 -0.365383 0.535500
C 5.241284 0.374636 -0.170479
C 6.592587 0.176588 0.550036
C 7.757143 0.925786 -0.137139
C 9.109127 0.724416 0.580749
H -2.624300 0.544605 1.342222
H -4.081097 -0.343611 -1.228715
H -2.638381 -1.947238 1.131634
H -2.098572 -1.829959 -0.557827
H -1.717467 0.582155 -1.608762
H -2.019482 2.010250 -0.595722
H -4.058128 2.146162 -1.013086
H -4.598360 2.026540 0.678586
H -4.976042 -0.390977 1.724569
H -4.676914 -1.816692 0.702075
H -0.510562 -0.952152 1.960231
H -0.178226 -2.389432 0.960246
H 0.433568 1.538134 -0.752154
H -0.146330 1.410129 0.934764
H 0.399894 -0.927336 -0.994325
H -6.507084 2.604449 -0.828865
H -6.192008 1.169054 -1.832280
H -6.563936 -1.217469 -0.799940
H -7.124720 -1.352915 0.883553
H -7.072693 1.142425 1.130922
H -8.084847 0.696906 -0.265936
H 3.922826 0.014070 1.560353
H 4.342153 -1.439974 0.644471
H 5.005322 1.455852 -0.227438
H 5.311925 0.019390 -1.215776
H 6.510088 0.519642 1.602881
H 6.832855 -0.906837 0.593930
H 7.518115 2.007964 -0.181340
H 7.839192 0.583149 -1.188594
H 9.061214 1.086710 1.625214
H 9.387252 -0.346169 0.610246
H 9.923765 1.270823 0.070794


