%chk=000000620.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000620

0 1
 P   -4.495400     -0.3057000     -0.6454000    
 P   -3.249800       2.225100      0.1901000    
 O  -0.2920000      -1.297700     -0.7042000    
 O  -0.2361000      -1.846400       2.254900    
 O   -3.084300      -1.087600     -0.7629000    
 O   -4.196000      0.9258000      0.3584000    
 O   -5.428700      -1.286800      0.2398000    
 O   -5.097700      0.1034000      -1.958300    
 O   -3.575400       3.090000       1.516100    
 O   -3.969200       3.060000     -0.9921000    
 O   -1.798500       1.918000     -3.3100002E-02
 N    1.866900     -0.5104000     -9.6100003E-02
 N    2.358600       1.447300      0.8493000    
 N    4.011900      -1.036000      -1.107300    
 N    5.654000      0.7136000     -0.6615000    
 N    5.134700       2.666400      0.6205000    
 C  -0.2784000      -2.748600       1.157800    
 C   -1.130100      -2.222400      1.1300000E-02
 C    1.078600      -1.678500     -0.4955000    
 C    1.096200      -2.814100      0.5274000    
 C   -2.417200      -1.525200      0.4099000    
 C    3.177100     -0.2661000     -0.3932000    
 C    1.418900      0.5465000      0.6508000    
 C    3.462900      0.9521000      0.2023000    
 C    4.756900       1.439200      4.8500001E-02
 C    5.232000     -0.4617000      -1.187600    
 H  -0.6325000      -3.715900       1.526300    
 H   -1.351500      -3.032600     -0.6955000    
 H    1.483100      -2.012900      -1.457700    
 H    1.920100      -2.738200       1.244100    
 H    1.199100      -3.765400     -9.2000002E-03
 H   -2.207500     -0.6501000       1.031700    
 H   -3.065300      -2.210300      0.9649000    
 H   0.3639000      -2.223000       2.921000    
 H   0.4091000      0.6087000       1.030900    
 H    5.976100      -1.016200      -1.749300    
 H    4.467400       3.209300       1.151700    
 H    6.081200       2.998600      0.4955000    
 H   -5.860800      -2.051600     -0.1968000    
 H   -3.054100       3.901800       1.693300    
 H   -3.532100       3.867400      -1.337200    


%chk=000000620-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000000620

0 1
P -3.832510 -0.559242 1.480520
P -2.566197 2.107325 0.137579
O -0.657930 -0.770698 -1.021337
O 0.880289 -3.174131 0.449104
O -3.157087 -1.710824 0.413247
O -2.855765 0.867128 1.347103
O -3.193305 -1.114633 2.979683
O -5.388759 -0.379395 1.326951
O -4.115725 2.656116 -0.338257
O -2.161150 1.243812 -1.228991
O -1.591513 3.199041 0.738564
N 1.526279 0.207036 -1.156128
N 2.655930 2.187363 -0.841637
N 2.166190 -0.925645 0.982389
N 3.606930 0.468158 2.385202
N 4.276890 2.641289 1.752049
C 0.234185 -3.009611 -0.826925
C -1.085019 -2.187714 -0.755594
C 0.612076 -0.735998 -1.796221
C 1.073360 -2.214808 -1.878213
C -1.780856 -2.256451 0.594306
C 2.172480 0.100964 0.083530
C 1.848073 1.494888 -1.651929
C 2.863989 1.327441 0.253365
C 3.594891 1.497351 1.466398
C 2.911825 -0.663904 2.102495
H 0.014748 -4.027006 -1.194469
H -1.786290 -2.477275 -1.561582
H 0.385988 -0.314321 -2.791673
H 2.151120 -2.332042 -1.685456
H 0.862327 -2.592613 -2.893159
H -1.221687 -1.706258 1.367936
H -1.884918 -3.307262 0.910632
H 1.382402 -2.303699 0.719934
H 1.449831 1.854541 -2.598761
H 2.945782 -1.456242 2.855049
H 4.252356 3.423967 1.100490
H 4.764878 2.717852 2.642860
H -3.144394 -0.427268 3.691391
H -4.448453 3.431672 0.181793
H -1.565162 0.390898 -1.128638


