%chk=000155309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155309

0 1
 P   0.1994000     -2.7000001E-03  0.2408000    
 O  -0.6088000       1.197800     -0.4895000    
 O  -0.3771000      -1.329100     -0.4822000    
 O    1.686100      0.1325000     -0.3802000    
 O   0.1262000     -4.4999998E-03   1.742100    
 C   -1.948000       1.419000     -0.3861000    
 C   -4.108100      0.8029000      0.5037000    
 C   -2.735900      0.5762000      0.3979000    
 C   -2.532400       2.488900      -1.064100    
 C   -4.692500       1.872800     -0.1742000    
 C   9.9100001E-02  -2.597700     -0.2900000    
 C    2.532800       1.186300     -0.1673000    
 C   -3.904600       2.715800     -0.9580000    
 C   -4.950700     -9.7000003E-02   1.343000    
 C    1.159000      -2.811700      0.5850000    
 C    2.127300       2.245700      0.6379000    
 C  -0.4803000      -3.662300     -0.9726000    
 C    3.791700       1.189700     -0.7592000    
 C    1.644900      -4.104700      0.7796000    
 C    2.990200       3.320300      0.8534000    
 C   5.2999998E-03  -4.955300     -0.7779000    
 C    4.654600       2.264100     -0.5435000    
 C    1.068000      -5.176600      9.8300003E-02
 C    4.253900       3.329500      0.2629000    
 H   -2.316100     -0.2646000      0.9392000    
 H   -1.923600       3.149000      -1.675800    
 H   -5.760000       2.062100     -9.8700002E-02
 H   -4.359400       3.549300      -1.485400    
 H   -4.618700      -1.137100       1.254900    
 H   -4.892300      0.2052000       2.393300    
 H   -6.000300     -6.8200000E-02   1.031300    
 H    1.640400      -2.011800       1.135200    
 H    1.156000       2.284500       1.116800    
 H   -1.308000      -3.494300      -1.655900    
 H    4.107600      0.3621000      -1.388000    
 H    2.472600      -4.277600       1.461300    
 H    2.678600       4.150300       1.480800    
 H  -0.4438000      -5.789700      -1.308500    
 H    5.638500       2.271300      -1.003500    
 H    1.446300      -6.183200      0.2498000    
 H    4.925700       4.166100      0.4308000    


%chk=000155309-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000155309

0 1
P 0.171288 -0.143435 0.004635
O -0.792309 1.001193 -0.844513
O -0.183619 -1.571121 -0.891573
O 1.726974 0.234529 -0.631325
O 0.020818 -0.209367 1.585799
C -2.203342 1.162830 -0.625638
C -4.152949 1.440412 0.816698
C -2.760839 1.206177 0.667461
C -2.977574 1.351719 -1.787588
C -4.941926 1.635473 -0.344932
C 0.322531 -2.867697 -0.544128
C 2.537332 1.313516 -0.143289
C -4.358516 1.596332 -1.632993
C -4.768112 1.499001 2.204353
C 0.349763 -3.337619 0.786895
C 2.697714 1.575734 1.234690
C 0.719890 -3.672356 -1.630978
C 3.226209 2.046788 -1.130424
C 0.800775 -4.656660 1.022076
C 3.574704 2.615101 1.621052
C 1.155111 -4.991545 -1.376168
C 4.107285 3.072808 -0.723232
C 1.200606 -5.485865 -0.051203
C 4.281441 3.362279 0.650722
H -2.124466 1.055973 1.546583
H -2.499626 1.305635 -2.769853
H -6.017507 1.818413 -0.240298
H -4.981570 1.747973 -2.521021
H -4.476981 0.622341 2.811139
H -4.430278 2.399584 2.751546
H -5.869914 1.530153 2.155702
H 0.031937 -2.691464 1.611113
H 2.151635 0.988736 1.979646
H 0.682029 -3.261496 -2.643849
H 3.066499 1.806871 -2.185446
H 0.831570 -5.035244 2.049556
H 3.707471 2.833265 2.686301
H 1.463230 -5.627692 -2.212908
H 4.650767 3.647587 -1.480878
H 1.543683 -6.507694 0.142246
H 4.961862 4.162130 0.961424


