%chk=000256127.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256127

0 1
P 0.538237 -0.166273 0.094018
O -2.756020 -0.606242 -2.024093
O -2.521899 0.503195 -0.056471
C 2.178289 -0.790050 -0.477242
C 0.193430 -0.942279 1.732728
C 0.758356 1.628747 0.457882
C -0.653855 -0.546372 -1.106052
C -4.192429 -0.313281 -2.117403
C 3.009358 -1.527345 0.364859
C -0.753161 -1.962995 1.791520
C 2.031955 2.201723 0.457386
C 2.547549 -0.508506 -1.794721
C 0.852243 -0.493086 2.879543
C -0.377307 2.387476 0.738009
C -1.983048 -0.148925 -0.958828
C -4.391690 1.198901 -2.193306
C -4.546373 -1.010437 -3.436130
C -4.909836 -0.939768 -0.923435
C 4.242630 -1.981991 -0.118805
C -1.030278 -2.565832 3.027155
C 2.168838 3.562916 0.746560
C 3.781880 -0.965116 -2.271085
C 0.571852 -1.099185 4.107622
C -0.231814 3.751386 1.026829
C 4.627627 -1.699882 -1.433234
C -0.368009 -2.135956 4.179083
C 1.036270 4.336456 1.031177
H -0.375729 -1.115043 -1.983127
H 2.725292 -1.770337 1.392168
H -1.295420 -2.297578 0.898399
H 2.928919 1.620760 0.232731
H 1.894148 0.055316 -2.469227
H 1.571828 0.327959 2.846318
H -1.392595 1.944299 0.729841
H -3.777765 1.639720 -2.985128
H -5.434947 1.462973 -2.376823
H -4.080628 1.671346 -1.246973
H -4.307994 -2.079333 -3.387545
H -3.960761 -0.595603 -4.264896
H -5.607260 -0.901454 -3.671897
H -4.578727 -0.459261 0.012654
H -5.993346 -0.826919 -0.995838
H -4.677380 -2.005155 -0.835064
H 4.899517 -2.560439 0.528966
H -1.770502 -3.362301 3.086142
H 3.154638 4.022953 0.747360
H 4.080491 -0.752421 -3.296784
H 1.075392 -0.759960 5.010705
H -1.114123 4.352109 1.243786
H 5.587309 -2.056717 -1.807492
H -0.587042 -2.602739 5.139270
H 1.146592 5.397243 1.254189


%chk=000256127-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256127

0 1
P 0.540337 -0.116845 0.088025
O -2.774485 -0.625275 -2.109357
O -2.481972 0.486245 -0.028659
C 2.185617 -0.782334 -0.488697
C 0.172717 -0.906032 1.755265
C 0.812190 1.705988 0.482226
C -0.620316 -0.530079 -1.182074
C -4.262139 -0.355819 -2.151550
C 3.004502 -1.558791 0.364245
C -0.670737 -2.038783 1.784303
C 2.113161 2.264968 0.448227
C 2.606907 -0.497377 -1.812471
C 0.728177 -0.390587 2.949578
C -0.308791 2.512776 0.808591
C -1.988162 -0.164849 -1.022446
C -4.524150 1.165588 -2.175491
C -4.668459 -1.009004 -3.486047
C -4.953568 -1.049858 -0.958244
C 4.241459 -2.054269 -0.108542
C -0.949904 -2.669801 3.016859
C 2.295281 3.636476 0.741486
C 3.842620 -0.996560 -2.279706
C 0.447637 -1.026541 4.180482
C -0.113999 3.882121 1.096359
C 4.662389 -1.774693 -1.428583
C -0.388883 -2.167035 4.214514
C 1.183268 4.446521 1.065847
H -0.253318 -1.092319 -2.039946
H 2.677493 -1.788096 1.383913
H -1.109232 -2.402060 0.847014
H 2.980197 1.645627 0.193240
H 1.972244 0.107165 -2.469851
H 1.355994 0.507583 2.925581
H -1.308632 2.062434 0.815933
H -3.957314 1.636450 -2.998813
H -5.601228 1.355920 -2.341302
H -4.217533 1.625403 -1.223246
H -4.413130 -2.083015 -3.481877
H -4.137479 -0.529750 -4.326941
H -5.756975 -0.903143 -3.646373
H -4.608735 -0.613006 -0.008037
H -6.050085 -0.925974 -1.036713
H -4.725669 -2.131261 -0.961437
H 4.869929 -2.660382 0.552863
H -1.610904 -3.542902 3.044018
H 3.302516 4.067122 0.715664
H 4.163107 -0.777161 -3.303797
H 0.873461 -0.628680 5.108193
H -0.979081 4.507371 1.343558
H 5.620600 -2.161571 -1.792731
H -0.610858 -2.654550 5.170545
H 1.326635 5.509341 1.291704


