%chk=000191092.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191092

0 1
P 3.261164 -0.743802 0.697677
P 3.304641 -0.956012 -2.326505
O 0.552051 4.182049 0.082901
O -1.613349 3.743824 -1.074195
O 2.750131 0.618009 1.373417
O 2.616756 -0.757683 -0.826770
O 2.320957 -1.863633 1.427597
O 4.713517 -0.976682 0.598218
O 3.376411 -2.599922 -2.329507
O 4.846510 -0.542325 -2.101244
O 2.528065 -0.316471 -3.380189
N -2.092007 0.350546 -0.656390
N -3.650219 -1.333364 -0.862594
N -1.751194 0.224529 1.836182
N -3.144238 -1.499915 2.881189
N -4.602014 -2.901639 1.656387
C 0.986817 1.762735 0.154639
C -1.170397 1.428931 -1.070546
C 0.305985 0.987074 -0.987387
C 0.040334 2.928891 0.532431
C -1.327023 2.676274 -0.161757
C 1.304360 0.887488 1.371820
C -2.301983 -0.151959 0.631093
C -2.942568 -0.413167 -1.525741
C -3.280322 -1.199878 0.484571
C -3.692536 -1.879544 1.671242
C -2.221229 -0.488091 2.895373
H 1.954220 2.202496 -0.208492
H -1.434780 1.720892 -2.125971
H 0.814194 1.190852 -1.953138
H 0.399850 -0.109660 -0.856404
H -0.059678 3.083223 1.628559
H -2.163587 2.599992 0.564112
H 0.713001 -0.046464 1.424201
H 1.197406 1.433861 2.332602
H 0.698976 4.168078 -0.894739
H -1.453680 4.616663 -0.631451
H -2.975905 -0.226322 -2.591265
H -1.817172 -0.226647 3.889215
H 2.484848 -2.822129 1.225247
H -5.047677 -3.173114 0.792740
H -4.897924 -3.341350 2.514118
H 2.844410 -3.090713 -3.002873
H 5.316478 -0.853824 -1.230072


%chk=000191092-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191092

0 1
P 4.144274 -0.116779 0.107618
P 2.802336 -1.956280 -2.035051
O 0.232559 4.090727 1.515682
O -1.377251 3.893985 -0.576980
O 3.466019 1.414516 0.168955
O 2.956379 -1.283707 -0.387980
O 4.313076 -0.497822 1.760243
O 5.411976 -0.215265 -0.858853
O 2.652318 -3.616338 -1.670358
O 4.364023 -1.865391 -2.641946
O 1.590002 -1.318995 -2.827316
N -2.107591 0.385210 -0.703612
N -3.646854 -1.173868 -1.405654
N -2.200582 -0.036565 1.750870
N -3.804672 -1.816609 2.314647
N -5.080977 -2.963213 0.689622
C 1.075640 2.087391 0.217115
C -1.060711 1.419971 -0.764087
C 0.357370 0.872826 -0.411224
C -0.047191 2.734281 1.087446
C -1.318692 2.630351 0.193025
C 2.300424 1.784050 1.066787
C -2.565186 -0.261184 0.450975
C -2.785994 -0.209326 -1.780753
C -3.517041 -1.213795 -0.004694
C -4.147469 -2.011272 0.995996
C -2.871681 -0.861094 2.611866
H 1.362478 2.815005 -0.567793
H -1.056768 1.817137 -1.794850
H 0.856249 0.460269 -1.301621
H 0.265013 0.063409 0.335958
H -0.210381 2.133727 1.999735
H -2.231004 2.497649 0.798736
H 2.121984 0.972711 1.796596
H 2.653058 2.688245 1.588821
H -0.089423 4.678503 0.776083
H -2.314142 4.179980 -0.696644
H -2.599670 0.094702 -2.809007
H -2.636007 -0.743762 3.673897
H 4.553702 -1.436751 1.967814
H -5.347959 -3.118607 -0.280260
H -5.501825 -3.502714 1.443332
H 1.735461 -3.975121 -1.791954
H 4.996329 -1.228089 -2.132883


