%chk=000263429.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000263429

0 1
P 3.173599 -0.918421 -0.427891
O 1.609524 -1.456648 -0.326419
O -0.684984 -2.139004 -1.872583
O 3.542729 -0.877930 1.180621
O 3.911259 -2.276622 -0.955542
O 3.417836 0.303273 -1.203769
O 0.777843 3.649265 -1.537976
O 0.045067 1.730925 -2.205452
O -3.555713 -0.915609 2.487876
O -1.575207 -1.543770 1.920527
N 0.457056 2.490991 -1.340775
N -2.645976 -1.000534 1.678460
C 0.587842 -0.476188 -0.663784
C -0.686301 -1.369990 -0.656799
C 0.564189 0.620998 0.376302
C -1.960199 -0.556566 -0.728204
C 0.530187 1.990947 0.055255
C -2.857227 -0.398899 0.346158
C 0.614265 0.255561 1.730708
C -2.267974 0.057988 -1.953386
C 0.560489 2.967742 1.066113
C 0.631062 1.223619 2.737130
C -4.035398 0.359137 0.186166
C -3.432996 0.809497 -2.109257
C 0.607468 2.582354 2.405245
C -4.319739 0.961375 -1.035724
C 4.457582 0.177399 1.562320
C 3.710633 -3.451662 -0.127361
H 0.778749 -0.101386 -1.708304
H -0.649718 -2.082107 0.208431
H 0.637734 -0.810603 1.996248
H -1.570507 -0.060952 -2.793622
H 0.119712 -2.710266 -1.896091
H 0.551591 4.029412 0.792092
H 0.660368 0.914706 3.784323
H -4.724833 0.465564 1.032554
H -3.650039 1.281168 -3.070432
H 0.625134 3.340223 3.189447
H -5.231328 1.547656 -1.156455
H 4.265953 0.291892 2.638721
H 4.261730 1.123063 1.036506
H 5.487032 -0.164715 1.393623
H 4.336251 -4.202038 -0.633141
H 2.657384 -3.759885 -0.142784
H 4.069774 -3.281960 0.896623


%chk=000263429-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000263429

0 1
P 3.222217 -0.934572 -0.638183
O 1.592978 -1.424676 -0.307682
O -0.552604 -2.303249 -1.704171
O 3.762501 -0.596931 0.972492
O 3.915512 -2.446808 -1.055949
O 3.441723 0.204724 -1.712687
O 0.410280 3.895715 -0.926088
O -0.354620 1.939715 -1.800593
O -3.083102 0.675263 2.393215
O -2.110948 -1.341287 2.006258
N 0.121796 2.643017 -0.824572
N -2.674401 -0.252220 1.592895
C 0.484296 -0.425292 -0.515570
C -0.757421 -1.378337 -0.588132
C 0.465383 0.574856 0.631805
C -2.058586 -0.626345 -0.860246
C 0.324566 1.986056 0.494207
C -2.902605 -0.061495 0.136445
C 0.646216 0.078107 1.948421
C -2.434753 -0.416983 -2.208685
C 0.358703 2.856890 1.608552
C 0.652973 0.929744 3.069610
C -4.049983 0.700633 -0.192632
C -3.587204 0.318189 -2.552322
C 0.510705 2.326814 2.901531
C -4.395993 0.888635 -1.542165
C 4.922931 0.319037 1.138370
C 3.862101 -3.583922 -0.101063
H 0.626924 0.058163 -1.494191
H -0.816406 -1.929926 0.365116
H 0.798876 -0.996024 2.081397
H -1.798875 -0.852166 -2.983238
H 0.351099 -2.696437 -1.583977
H 0.256108 3.931297 1.436677
H 0.764115 0.503685 4.071520
H -4.652775 1.121717 0.616237
H -3.846148 0.456014 -3.607122
H 0.510812 2.994764 3.768366
H -5.287422 1.468269 -1.801477
H 4.871903 0.643533 2.187929
H 4.838002 1.186045 0.460567
H 5.867221 -0.220867 0.948541
H 4.451746 -4.373983 -0.588265
H 2.820089 -3.915837 0.047859
H 4.313970 -3.304524 0.866699


