%chk=000242669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242669

0 1
O 5.502620 0.605716 -1.071959
O 5.251933 0.090826 1.088134
O -5.177865 -0.011872 -0.236000
N 1.143860 -0.956973 -0.104444
C 0.455657 0.266233 0.445164
C 1.085574 1.481064 -0.278686
C 2.584998 -0.966791 0.297744
C 3.269199 0.238093 -0.387818
C 2.589234 1.562929 0.005392
C 0.446744 -2.213793 0.306770
C -1.046860 0.208077 0.245312
C -0.911797 -2.234181 -0.409938
C -1.699563 -0.984116 -0.142691
C -1.812802 1.352360 0.496617
C 4.724841 0.282710 0.017985
C -3.086991 -1.010687 -0.293095
C -3.203425 1.350691 0.354305
C -3.824006 0.162062 -0.046020
C -6.043364 1.127375 -0.015801
H 0.637523 0.368487 1.551825
H 0.590105 2.416794 0.037767
H 0.903883 1.386372 -1.369086
H 3.046540 -1.912645 -0.060502
H 2.744824 -0.922256 1.398197
H 3.192977 0.110255 -1.502031
H 3.037755 2.401486 -0.561852
H 2.765338 1.781678 1.077495
H 0.305877 -2.301505 1.405551
H 1.054455 -3.086248 -0.015603
H -1.478937 -3.138384 -0.114991
H -0.748915 -2.315592 -1.509595
H -1.321641 2.274713 0.812171
H -3.611777 -1.912864 -0.597056
H -3.769705 2.252430 0.552434
H 6.470962 0.658784 -0.854955
H -5.794460 1.934073 -0.711069
H -5.984694 1.453292 1.026467
H -7.031495 0.705307 -0.240938


%chk=000242669-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242669

0 1
O 5.474215 1.115276 -0.896245
O 5.389922 -0.515349 0.751062
O -5.265571 -0.013630 -0.260170
N 1.153147 -0.976017 -0.045347
C 0.473197 0.263335 0.421270
C 1.122958 1.473621 -0.302600
C 2.587007 -0.979075 0.315129
C 3.306010 0.178027 -0.408239
C 2.641890 1.536446 -0.036028
C 0.444585 -2.210519 0.359169
C -1.045878 0.197721 0.221979
C -0.898662 -2.279627 -0.383942
C -1.703883 -1.008071 -0.159517
C -1.837547 1.343727 0.468469
C 4.788264 0.184498 -0.095036
C -3.106969 -1.025695 -0.307631
C -3.241693 1.334862 0.323092
C -3.879122 0.135384 -0.077494
C -6.106001 1.160258 -0.019812
H 0.664106 0.397273 1.524260
H 0.656798 2.415369 0.039219
H 0.923995 1.373889 -1.386132
H 3.027002 -1.945047 0.009454
H 2.749312 -0.878612 1.418033
H 3.190178 0.037856 -1.501002
H 3.108569 2.352904 -0.614082
H 2.822130 1.743075 1.038910
H 0.273347 -2.254817 1.464782
H 1.075535 -3.076440 0.087320
H -1.479161 -3.161248 -0.051599
H -0.692665 -2.406823 -1.464584
H -1.356511 2.275136 0.789617
H -3.625241 -1.946726 -0.596243
H -3.812813 2.245681 0.525065
H 6.441433 1.094538 -0.660088
H -5.844417 1.991763 -0.703485
H -6.026970 1.506355 1.029610
H -7.133896 0.824603 -0.221962


