%chk=000259102.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259102

0 1
P -2.030872 0.892774 0.568551
P 2.021321 -0.894081 0.605414
O -1.648302 2.134331 1.333403
O 1.628738 -2.126414 1.380047
C -0.655091 -0.386020 0.404469
C 0.647874 0.382548 0.408175
C -2.541696 1.261981 -1.177038
C -3.461209 -0.025001 1.301366
C 2.554738 -1.284145 -1.128846
C 3.442108 0.032503 1.345659
C -2.955705 0.270594 -2.064081
C -3.780626 -1.330729 0.932748
C 2.980175 -0.303469 -2.022389
C 4.173748 -0.639688 2.323110
C -2.492123 2.600990 -1.560103
C -4.205524 0.658781 2.261026
C 2.510144 -2.627679 -1.496306
C 3.766560 1.333658 0.965495
C -3.322593 0.627946 -3.366800
C -4.877614 -1.961203 1.530760
C 3.363870 -0.676465 -3.315822
C 5.264346 0.002016 2.925993
C -2.859974 2.955496 -2.865157
C -5.303828 0.024163 2.857408
C 2.894861 -2.997871 -2.792133
C 4.855847 1.971240 1.570035
C -3.273444 1.969256 -3.765031
C -5.638208 -1.282095 2.490423
C 3.319902 -2.022518 -3.698425
C 5.603767 1.303725 2.547612
H -0.792854 -0.992911 -0.510834
H -0.717244 -1.105881 1.257410
H 0.699128 1.112699 1.253043
H 0.797435 0.978279 -0.512590
H -3.008223 -0.778908 -1.772349
H -3.196125 -1.882141 0.195460
H 3.028911 0.749477 -1.742652
H 3.908240 -1.657033 2.635894
H -2.173401 3.381930 -0.858035
H -3.944161 1.679880 2.564938
H 2.182381 -3.400166 -0.789064
H 3.191780 1.876175 0.214100
H -3.648618 -0.135607 -4.069862
H -5.137607 -2.980861 1.254095
H 3.698943 0.078570 -4.023812
H 5.842734 -0.513488 3.690442
H -2.826106 3.998218 -3.174809
H -5.892127 0.548751 3.607987
H 2.865027 -4.044276 -3.089535
H 5.119644 2.987453 1.284442
H -3.560740 2.244193 -4.779313
H -6.491206 -1.776252 2.954496
H 3.620301 -2.309603 -4.705518
H 6.450799 1.803375 3.016705


%chk=000259102-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259102

0 1
P -2.149764 0.744477 0.818557
P 2.136375 -0.741810 0.859091
O -2.018466 1.937722 1.907758
O 1.989374 -1.921161 1.961234
C -0.653268 -0.412389 0.769540
C 0.640922 0.414228 0.772208
C -2.288977 1.449455 -0.917417
C -3.643042 -0.336254 1.151547
C 2.299321 -1.469568 -0.865570
C 3.625225 0.343344 1.196727
C -2.268945 0.655888 -2.088367
C -3.904736 -1.539288 0.455337
C 2.307097 -0.689856 -2.045921
C 4.497165 -0.099279 2.218412
C -2.407763 2.856198 -1.007199
C -4.517442 0.110769 2.169214
C 2.406211 -2.878307 -0.936505
C 3.885956 1.546128 0.499599
C -2.372358 1.274670 -3.355280
C -5.054213 -2.295882 0.777541
C 2.426085 -1.324759 -3.303419
C 5.642437 0.663773 2.538174
C -2.512586 3.470471 -2.275593
C -5.665805 -0.648716 2.486425
C 2.526502 -3.508763 -2.195582
C 5.032355 2.306300 0.824334
C -2.496275 2.680968 -3.449331
C -5.935835 -1.849868 1.790101
C 2.537678 -2.733268 -3.378654
C 5.911836 1.864283 1.840472
H -0.730493 -1.054448 -0.126708
H -0.700694 -1.060396 1.663024
H 0.675548 1.076170 1.656022
H 0.730601 1.041768 -0.133133
H -2.172206 -0.435107 -2.031842
H -3.223917 -1.901589 -0.324292
H 2.220795 0.402667 -2.003635
H 4.255862 -1.026600 2.751347
H -2.409444 3.441486 -0.079746
H -4.275767 1.039076 2.700294
H 2.387422 -3.452262 -0.002155
H 3.206100 1.906096 -0.281963
H -2.358132 0.662297 -4.263612
H -5.259212 -3.230343 0.243827
H 2.433693 -0.723290 -4.219086
H 6.319466 0.325288 3.330052
H -2.606645 4.559594 -2.348254
H -6.344823 -0.306846 3.275146
H 2.611392 -4.599513 -2.253693
H 5.236408 3.240602 0.289977
H -2.579603 3.158112 -4.432397
H -6.825963 -2.439031 2.037845
H 2.633081 -3.222963 -4.354427
H 6.799567 2.456225 2.090176


