%chk=000077441.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077441

0 1
 P  -2.2000000E-03 -6.0000003E-04 -0.3440000    
 O   0.5408000       1.355700      0.3486000    
 O   -1.448100     -0.2086000      0.3490000    
 O   0.9086000      -1.150000      0.3470000    
 O  -2.4999999E-03 -3.9999999E-04  -1.847200    
 C   -1.122500       5.123900     -0.1639000    
 C   -3.880300      -3.532900     -0.1636000    
 C    5.004200      -1.589900     -0.1641000    
 C   -1.719800       6.477800     -0.3486000    
 C   -4.754200      -4.726900     -0.3483000    
 C    6.475500      -1.748200     -0.3482000    
 C  -7.7000000E-03   2.598000      0.1786000    
 C   -2.249900      -1.304600      0.1790000    
 C    2.251500      -1.294100      0.1785000    
 C   -1.678100       4.022200     -0.8147000    
 C   -2.648600      -3.463100     -0.8148000    
 C    4.327400     -0.5577000     -0.8140000    
 C  -8.1000002E-03   4.959300      0.6584000    
 C   -4.294500      -2.485600      0.6593000    
 C    4.304800      -2.474100      0.6571000    
 C   -1.119100       2.755800     -0.6428000    
 C   -1.831200      -2.345900     -0.6428000    
 C    2.951100     -0.4099000     -0.6427000    
 C   0.5509000       3.692900      0.8302000    
 C   -3.477100      -1.368500      0.8310000    
 C    2.928300      -2.326200      0.8283000    
 C   -2.802100       6.781000      0.6845000    
 C   -4.475300      -5.816100      0.6843000    
 C    7.278200     -0.9630000      0.6860000    
 H   -2.144100       6.565600      -1.356600    
 H  -0.9363000       7.243800     -0.2901000    
 H   -4.618500      -5.138100      -1.356500    
 H   -5.809300      -4.431500     -0.2893000    
 H    6.764000      -1.423300      -1.355800    
 H    6.748000      -2.809500     -0.2908000    
 H   -2.547600       4.137600      -1.456500    
 H   -2.314000      -4.273600      -1.457000    
 H    4.861800      0.1387000      -1.454900    
 H   0.4332000       5.809300       1.172200    
 H   -5.251000      -2.528600       1.173400    
 H    4.820700      -3.281300       1.170300    
 H   -1.586500       1.930600      -1.167100    
 H  -0.8829000      -2.337900      -1.167300    
 H    2.469600      0.4078000      -1.166700    
 H    1.418700       3.568800       1.472000    
 H   -3.803200     -0.5552000       1.473200    
 H    2.388400      -3.017600       1.469500    
 H   -3.622800       6.058400      0.6219000    
 H   -3.215000       7.780700      0.5165000    
 H   -2.399100       6.745600       1.702200    
 H   -3.439300      -6.165700      0.6212000    
 H   -5.134500      -6.673500      0.5163000    
 H   -4.645800      -5.449700       1.702300    
 H    7.062100      0.1089000      0.6244000    
 H    8.350600      -1.104100      0.5183000    
 H    7.045900      -1.295600       1.703300    


%chk=000077441-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077441

0 1
P 0.050113 -0.035201 0.162836
O 0.528507 1.434732 0.926554
O -1.424095 -0.349790 0.996724
O 1.099204 -1.147942 0.955215
O 0.016910 -0.061732 -1.426289
C -1.003257 5.305954 0.022107
C -4.210164 -3.449282 0.110049
C 5.200094 -1.831355 0.020133
C -1.576873 6.684292 -0.274776
C -5.193218 -4.574391 -0.181825
C 6.675644 -2.052789 -0.281233
C -0.030982 2.707369 0.568230
C -2.314915 -1.417636 0.639040
C 2.474695 -1.324394 0.582770
C -0.578767 4.450383 -1.026666
C -3.642024 -2.688082 -0.943620
C 4.256222 -1.670073 -1.025976
C -0.921457 4.824219 1.354863
C -3.803740 -3.160775 1.438752
C 4.737517 -1.737667 1.358919
C -0.085595 3.151974 -0.769542
C -2.699116 -1.666412 -0.695791
C 2.890639 -1.422852 -0.761740
C -0.444316 3.526637 1.637033
C -2.853406 -2.153651 1.712375
C 3.381522 -1.478121 1.649774
C -3.121147 6.656908 -0.435656
C -4.479087 -5.925176 -0.458673
C 7.475037 -0.721986 -0.318191
H -1.126280 7.087531 -1.201736
H -1.312859 7.385943 0.539598
H -5.815837 -4.311692 -1.058560
H -5.884336 -4.701345 0.673232
H 6.787593 -2.567195 -1.254647
H 7.120714 -2.717752 0.483750
H -0.625947 4.805227 -2.063403
H -3.947015 -2.888941 -1.977883
H 4.588958 -1.747473 -2.068192
H -1.237115 5.469792 2.183391
H -4.232486 -3.731676 2.271194
H 5.446143 -1.866506 2.186033
H 0.245854 2.500621 -1.584227
H -2.271193 -1.080203 -1.514780
H 2.168196 -1.309210 -1.576072
H -0.382209 3.144563 2.660051
H -2.530658 -1.927249 2.732655
H 3.017020 -1.399245 2.678013
H -3.418769 5.987129 -1.262623
H -3.513216 7.667899 -0.651041
H -3.607069 6.287259 0.485473
H -3.800665 -5.841549 -1.326985
H -5.213985 -6.723516 -0.670495
H -3.872339 -6.235973 0.411016
H 7.077663 -0.045673 -1.096539
H 8.543022 -0.908779 -0.534405
H 7.405970 -0.194246 0.650284


