%chk=000271184.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271184

0 1
P -0.937302 0.114019 -1.585809
O -1.191295 1.278179 -0.439753
O -2.365749 -0.726203 -1.594486
O -0.559064 0.643205 -2.891524
O -4.132163 2.118977 0.717570
O -5.124552 0.479486 -0.288131
O 2.089425 -2.927344 -0.934259
O 3.208826 2.108429 1.017370
N -4.197566 0.974003 0.320085
N 0.113575 -1.062830 -0.803269
C -3.022646 0.029568 0.701473
C -1.714482 0.842825 0.821738
C -2.912707 -1.116587 -0.329956
C -3.393293 -0.547377 2.069330
C 1.413867 -0.690142 -0.373348
C 2.427462 -1.699082 -0.360369
C 1.739441 0.583043 0.099601
C 3.049984 0.819652 0.567294
C 3.715756 -1.441211 0.093869
C 4.042876 -0.167536 0.572437
C 1.973960 -4.008713 0.026781
C 4.527711 2.519156 1.454996
H -1.890986 1.818327 1.338374
H -0.938263 0.273285 1.374197
H -2.325289 -1.961221 0.082307
H -3.925152 -1.484526 -0.630624
H -3.520587 0.239828 2.828846
H -4.334691 -1.116811 2.037968
H -2.618338 -1.229216 2.445884
H 0.102090 -2.039769 -1.190273
H 1.034915 1.418081 0.111505
H 4.467065 -2.230557 0.066920
H 5.047418 0.034836 0.924094
H 1.203155 -3.779941 0.765932
H 2.939122 -4.193214 0.505668
H 1.685630 -4.853577 -0.609469
H 4.833925 1.941914 2.331515
H 4.356684 3.572599 1.715083
H 5.245338 2.431844 0.633833


%chk=000271184-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271184

0 1
P -1.001420 0.222935 -1.584651
O -1.355090 1.392680 -0.339929
O -2.435990 -0.770262 -1.591974
O -0.673783 0.906652 -2.964214
O -4.357460 2.174453 0.650963
O -5.252380 0.464140 -0.554812
O 1.646485 -2.965545 -0.345947
O 3.489410 2.232784 0.749464
N -4.351719 0.973264 0.202108
N 0.109081 -0.891790 -0.840414
C -3.201307 0.024684 0.710901
C -1.915849 0.856523 0.918937
C -3.015780 -1.145134 -0.281096
C -3.700422 -0.520755 2.071450
C 1.389677 -0.596948 -0.303486
C 2.232528 -1.718541 -0.025423
C 1.848808 0.703289 -0.028020
C 3.144271 0.891139 0.518693
C 3.512957 -1.523194 0.514847
C 3.981566 -0.213885 0.792182
C 2.477169 -4.159051 -0.189083
C 4.828717 2.502870 1.272922
H -2.126339 1.750616 1.523737
H -1.167262 0.215042 1.424548
H -2.369783 -1.898340 0.212340
H -3.989060 -1.588185 -0.539456
H -3.906042 0.309308 2.768381
H -4.625338 -1.108872 1.942362
H -2.931537 -1.172506 2.521562
H -0.027611 -1.887910 -1.051760
H 1.232976 1.584561 -0.232403
H 4.164577 -2.376597 0.725181
H 4.983043 -0.082059 1.209258
H 2.763356 -4.308269 0.870114
H 3.387278 -4.094063 -0.815904
H 1.851838 -4.998575 -0.526678
H 4.973701 2.043333 2.270717
H 4.887912 3.597761 1.358037
H 5.612919 2.139848 0.579948


