%chk=000001026.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001026

0 1
 P   -2.574000      -1.830200      0.4342000    
 O   -1.803100     -0.4171000      0.5957000    
 O   -4.119600      -1.390200      0.2421000    
 O   -1.502100       2.868000     -0.8962000    
 O   -4.029400       1.425000      0.8884000    
 O   -2.132800      -2.364000      -1.028500    
 O    1.081500      -1.684300     -0.9962000    
 O   -2.341800      -2.809400       1.547400    
 N   0.7960000       1.043900      -1.009200    
 N    2.266600       1.445800       1.270800    
 N    4.318500      0.5234000      0.2325000    
 N    3.242900      -1.517600     -0.2204000    
 N    5.481800      -1.490300      0.4219000    
 C   -2.090300      0.6233000     -0.3380000    
 C   -1.275500       1.844400      6.6600002E-02
 C    2.148300      0.4911000      -1.004200    
 C   -3.599500      0.9049000     -0.3700000    
 C   0.1863000       1.536500      0.1321000    
 C    3.031200       1.204800      4.4500001E-02
 C   -4.418900     -0.3469000     -0.6800000    
 C   0.9195000       1.703700       1.245800    
 C    2.064200     -0.9972000     -0.7284000    
 C    4.350300     -0.7676000      0.1490000    
 H   -1.796900      0.2827000      -1.338100    
 H   -1.613100       2.225100       1.037700    
 H    2.591800      0.6037000      -2.001300    
 H   -3.818700       1.668000      -1.125300    
 H    3.267500       2.196300     -0.3643000    
 H   0.2266000      0.9221000      -1.839200    
 H   -5.489500     -0.1377000     -0.5908000    
 H   -4.226800     -0.7045000      -1.696300    
 H   0.5179000       2.056900       2.186800    
 H    2.767300       1.648900       2.129100    
 H   -1.232400       2.535000      -1.769100    
 H    3.306700      -2.527600     -0.1320000    
 H   -4.976800       1.630700      0.8137000    
 H   -2.266200      -1.803200      -1.821200    
 H    5.493400      -2.502000      0.3519000    
 H    6.342600      -1.032500      0.7010000    


%chk=000001026-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000001026

0 1
P -2.478681 -1.826904 0.466099
O -1.877977 -0.204383 0.779613
O -4.125035 -1.499992 0.041597
O -1.598650 2.867587 -1.236929
O -4.211698 1.471641 0.785235
O -1.780984 -2.213253 -1.038004
O 0.813149 -1.747318 -0.951053
O -2.308679 -2.803143 1.689815
N 0.744074 1.161470 -1.179329
N 2.236375 1.308218 1.198987
N 4.225320 0.413697 0.176527
N 2.959011 -1.630864 -0.149170
N 5.210604 -1.688122 0.555434
C -2.141986 0.726791 -0.365185
C -1.309570 1.983415 -0.066223
C 1.997088 0.452589 -1.100295
C -3.667070 0.943117 -0.467517
C 0.158362 1.676779 0.010768
C 2.970011 1.149621 -0.065452
C -4.371397 -0.362177 -0.904276
C 0.891694 1.722128 1.168597
C 1.836963 -1.045648 -0.726788
C 4.138032 -0.893795 0.189412
H -1.770351 0.272548 -1.303457
H -1.661914 2.445101 0.875382
H 2.508793 0.468832 -2.083710
H -3.863393 1.726001 -1.219853
H 3.247111 2.128687 -0.504922
H 0.383945 1.490881 -2.073206
H -5.464771 -0.240290 -0.873333
H -4.040984 -0.666038 -1.915813
H 0.430079 1.982451 2.122085
H 2.805827 1.479811 2.026987
H -1.214537 3.760172 -1.043584
H 2.856467 -2.608363 0.147155
H -3.986494 0.822993 1.503136
H -0.771462 -2.089207 -1.082329
H 5.274656 -2.668645 0.292372
H 6.051571 -1.204486 0.863729


