%chk=000241803.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241803

0 1
O 2.727436 -0.434790 -0.124052
O -1.536838 -0.751428 -3.103018
O -4.412933 -0.453365 1.954694
O -5.155274 2.052937 1.317007
C 0.042027 0.293473 -0.173657
C 1.114797 1.260764 0.367852
C 0.158126 0.140724 -1.700829
C -1.344122 0.764462 0.218694
C 2.507721 0.672594 0.328644
C -0.704957 -0.978651 -2.249799
C -2.190986 -0.134431 0.898949
C -1.788631 2.053526 -0.086199
C -3.464246 0.281696 1.266506
C 3.624813 1.520603 0.847462
C -0.489405 -2.366097 -1.731371
C -3.070773 2.481635 0.285278
C -3.910263 1.598977 0.961424
C 3.410221 2.648686 1.652659
C 0.730843 -2.780019 -1.180208
C 4.937576 1.148930 0.511342
C -1.551113 -3.279551 -1.840098
C 4.496105 3.400157 2.108480
C 0.882362 -4.095453 -0.731823
C 6.021649 1.903966 0.964711
C -1.398497 -4.590844 -1.385418
C 5.801065 3.030613 1.763050
C -0.180143 -4.999290 -0.831420
C -4.179040 -1.877070 2.082136
H 0.236753 -0.709985 0.295833
H 0.854878 1.539731 1.412371
H 1.100979 2.214324 -0.200140
H -0.120291 1.087183 -2.209973
H 1.218130 -0.052638 -1.978199
H -1.845420 -1.140402 1.124640
H -1.143962 2.742004 -0.629880
H -3.424514 3.483618 0.047095
H 2.400081 2.945842 1.934844
H 1.571734 -2.080244 -1.093294
H 5.099012 0.259554 -0.105486
H -2.491064 -2.953210 -2.293463
H 4.326587 4.275030 2.734721
H 1.832889 -4.414166 -0.306360
H 7.036898 1.612771 0.698262
H -2.222488 -5.296408 -1.471929
H 6.645788 3.620832 2.118617
H -0.057879 -6.023642 -0.481670
H -5.686987 1.325959 1.746740
H -5.103473 -2.213595 2.568657
H -4.061763 -2.335121 1.095324
H -3.309510 -2.056691 2.721196


%chk=000241803-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241803

0 1
O 2.752061 -0.511754 0.190632
O -1.745770 -0.638964 -2.850909
O -4.559131 -0.497075 1.908770
O -5.292565 2.023195 1.365029
C 0.046995 0.322047 -0.023405
C 1.141022 1.304009 0.463365
C 0.183300 0.091828 -1.569865
C -1.356116 0.796928 0.356365
C 2.552632 0.707906 0.482832
C -0.771385 -0.972380 -2.112512
C -2.255062 -0.111973 0.974812
C -1.801345 2.112899 0.080407
C -3.560511 0.296986 1.303120
C 3.703669 1.589070 0.874038
C -0.543571 -2.418973 -1.757567
C -3.109503 2.528529 0.416677
C -3.993926 1.624808 1.029657
C 3.529943 2.946184 1.261271
C 0.618093 -2.866382 -1.068928
C 5.014508 1.037460 0.854957
C -1.527923 -3.367369 -2.151356
C 4.644750 3.732732 1.620655
C 0.784425 -4.240267 -0.784938
C 6.126701 1.823822 1.211358
C -1.360907 -4.735228 -1.861217
C 5.944551 3.174923 1.595455
C -0.201124 -5.176006 -1.176180
C -4.244558 -1.905051 2.157257
H 0.235323 -0.645016 0.478036
H 0.899483 1.642508 1.492152
H 1.148214 2.222022 -0.157815
H -0.045723 1.033359 -2.100101
H 1.228666 -0.194795 -1.787060
H -1.922699 -1.134990 1.182493
H -1.134025 2.827279 -0.415347
H -3.461744 3.541589 0.201433
H 2.530499 3.392434 1.287988
H 1.394186 -2.157592 -0.758156
H 5.128902 -0.009657 0.555676
H -2.407825 -2.999308 -2.690148
H 4.502990 4.776849 1.919557
H 1.684383 -4.579659 -0.260320
H 7.132749 1.391164 1.191430
H -2.123225 -5.459277 -2.170053
H 6.809127 3.788128 1.873080
H -0.066190 -6.240903 -0.954037
H -5.763601 1.242944 1.762145
H -5.160154 -2.340446 2.583495
H -3.982934 -2.422869 1.214777
H -3.411759 -2.002172 2.879897


