%chk=000231028.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231028

0 1
O -3.426178 0.451751 -0.441107
O -0.132540 1.041021 0.151458
O 0.402087 -0.974786 -0.735685
C -5.417634 -0.791371 -0.365032
C -4.641920 0.337921 0.342150
C -4.826745 -2.157916 -0.010320
C -6.901548 -0.709831 0.004536
C -2.488631 1.422796 0.074647
C -1.243640 1.205387 -0.781760
C 1.653476 -0.061527 1.172713
C 3.053890 -0.126205 0.625310
C 0.616871 -0.114194 0.081448
C 3.417248 -1.144675 -0.269364
C 4.005579 0.819452 1.032481
C 4.726536 -1.215801 -0.748800
C 5.315521 0.740291 0.549747
C 5.678694 -0.275850 -0.338844
H -5.304152 -0.633912 -1.469639
H -5.176810 1.301238 0.305387
H -4.386021 0.091306 1.384676
H -4.958549 -2.404369 1.047496
H -5.289294 -2.958040 -0.596972
H -3.747961 -2.173442 -0.222682
H -7.468361 -1.513417 -0.480769
H -7.347946 0.238544 -0.312584
H -7.060452 -0.811484 1.083459
H -2.282371 1.228915 1.143540
H -2.918218 2.431735 -0.045784
H -1.348787 0.307266 -1.429860
H -0.960106 2.083127 -1.384144
H 1.483480 -0.921678 1.862652
H 1.505364 0.852079 1.793766
H 2.669342 -1.869957 -0.600308
H 3.731013 1.616525 1.720219
H 5.005350 -2.005497 -1.445344
H 6.053636 1.475152 0.867249
H 6.698676 -0.334752 -0.713135


%chk=000231028-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231028

0 1
O -3.244766 -0.058023 -0.831556
O -0.278611 -0.419027 -0.768942
O 1.200507 -1.316199 -2.330279
C -5.339684 -0.521293 0.325881
C -4.376311 0.580303 -0.146224
C -4.654327 -1.457073 1.346917
C -6.622568 0.116598 0.908947
C -2.245935 0.908288 -1.283362
C -1.082542 0.146157 -1.891076
C 1.627493 -1.608160 0.090736
C 2.819395 -0.696477 0.392918
C 0.861366 -1.131480 -1.138044
C 3.887045 -0.576807 -0.534007
C 2.871923 0.040483 1.601479
C 4.988189 0.261015 -0.251352
C 3.975387 0.878119 1.885944
C 5.037675 0.990116 0.960328
H -5.612944 -1.117463 -0.568183
H -4.893696 1.278321 -0.844109
H -4.007322 1.169944 0.725271
H -4.400587 -0.904625 2.273046
H -5.320458 -2.294906 1.624031
H -3.721876 -1.871417 0.927379
H -7.330865 -0.666355 1.235215
H -7.139100 0.752476 0.165181
H -6.387897 0.743318 1.791216
H -1.890765 1.537268 -0.437979
H -2.683069 1.580383 -2.057363
H -1.438531 -0.678944 -2.531992
H -0.430904 0.808955 -2.489076
H 1.980997 -2.632310 -0.126401
H 0.942410 -1.644732 0.952336
H 3.845257 -1.132313 -1.478227
H 2.048362 -0.040994 2.321012
H 5.807178 0.344774 -0.974746
H 4.004482 1.440091 2.826366
H 5.893990 1.637790 1.179514


