%chk=000245474.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245474

0 1
P 0.131576 1.868187 -0.298095
O 1.072072 2.915729 0.578676
O 1.091156 1.479939 -1.590126
O -1.204464 2.384938 -0.683191
O -4.115316 0.572002 0.495052
O -2.488669 1.113461 1.934935
C 0.254623 0.355559 0.795365
C -0.721282 -0.668126 0.291610
C 1.596026 -0.290806 0.576823
C -0.014876 -1.782323 -0.266371
C 1.423362 -1.553942 -0.074536
C -2.112490 -0.664112 0.321385
C 2.859782 0.168088 0.912816
C -0.706493 -2.841130 -0.835826
C 2.522955 -2.338527 -0.391190
C -2.806376 -1.739558 -0.275601
C -2.113188 -2.803548 -0.846441
C 3.966936 -0.637282 0.590726
C 3.802412 -1.865888 -0.050726
C -2.845563 0.425075 1.003840
C 0.771801 4.314701 0.370391
C 0.730007 2.138859 -2.826784
H 0.062848 0.648255 1.861331
H 2.999165 1.131634 1.402967
H -0.174970 -3.688196 -1.266537
H 2.403500 -3.296878 -0.889793
H -3.899661 -1.720546 -0.281593
H -2.665207 -3.624101 -1.304228
H 4.967383 -0.289973 0.846339
H 4.675178 -2.470175 -0.293114
H 1.315320 4.671919 -0.512405
H 1.171088 4.787469 1.279598
H -0.307825 4.510030 0.287870
H 1.122707 1.451906 -3.590613
H 1.251557 3.102002 -2.878990
H -0.356578 2.262313 -2.949519
H -4.595098 1.340546 0.909957


%chk=000245474-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245474

0 1
P 0.068635 1.948554 -0.276637
O 1.072732 2.974849 0.710187
O 1.010990 1.540580 -1.685410
O -1.340317 2.587023 -0.677344
O -4.267933 0.394201 0.605544
O -2.441716 1.151386 1.818193
C 0.219822 0.360645 0.762031
C -0.745658 -0.700427 0.259489
C 1.583394 -0.291221 0.585543
C -0.010292 -1.798116 -0.276918
C 1.427741 -1.555901 -0.055965
C -2.158647 -0.706904 0.256619
C 2.853521 0.186511 0.946518
C -0.686938 -2.891112 -0.860397
C 2.554593 -2.356318 -0.337939
C -2.832501 -1.804421 -0.347374
C -2.101240 -2.876467 -0.904946
C 3.982624 -0.623269 0.670719
C 3.834163 -1.880484 0.032105
C -2.913725 0.366894 0.958959
C 1.010320 4.435804 0.485910
C 0.618372 2.122612 -2.988222
H -0.005134 0.710853 1.783314
H 2.963510 1.170555 1.412714
H -0.130665 -3.740755 -1.271031
H 2.447661 -3.330766 -0.827625
H -3.925604 -1.807627 -0.360130
H -2.639289 -3.713533 -1.362477
H 4.982873 -0.272626 0.948067
H 4.721401 -2.489134 -0.175451
H 1.660672 4.723069 -0.360451
H 1.383171 4.888854 1.416925
H -0.029327 4.757699 0.295394
H 0.801359 1.334418 -3.735101
H 1.250541 3.002235 -3.204420
H -0.448243 2.412127 -2.985367
H -4.707468 1.137713 1.098979


