%chk=000124908.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124908

0 1
 P    4.162800       1.784000      3.1399999E-02
 O   0.8509000     -0.7817000       1.069300    
 O  -0.8126000      -3.017700      -1.200700    
 O    1.251000      -3.733200      0.4164000    
 O    3.266100      0.5687000      0.6151000    
 O   -3.293600      -1.426400      0.5526000    
 O    3.270400       2.370500      -1.182900    
 O    5.364600       1.013800     -0.7286000    
 O    4.601800       2.793900       1.051000    
 O   -5.437300      0.6599000      0.1423000    
 N   -1.295600     -0.2174000      0.2303000    
 N   -2.044100       1.826800     -0.2230000    
 N   -4.701500       2.754100     -0.3762000    
 C   0.1015000      -2.013900     -0.8092000    
 C    1.447400      -2.568800     -0.3859000    
 C  -0.3453000      -1.303300      0.4593000    
 C    1.997200      -1.451500      0.4952000    
 C    2.811100     -0.4276000     -0.2836000    
 C   -2.660700     -0.2959000      0.2786000    
 C  -0.9740000       1.077900     -7.4400000E-02
 C   -3.098900      0.9766000     -3.8000001E-03
 C   -4.461200       1.411200     -7.3200002E-02
 H   0.2241000      -1.308200      -1.638900    
 H    2.087300      -2.846500      -1.228300    
 H  -0.7920000      -1.987100       1.189300    
 H    2.588000      -1.835700       1.334400    
 H    2.197600      5.1300000E-02  -1.053000    
 H    3.669200     -0.9119000     -0.7599000    
 H  -0.8741000      -3.666400     -0.4790000    
 H    2.128000      -4.035100      0.7086000    
 H   4.6599999E-02   1.419500     -0.1806000    
 H   -2.663600      -2.164300      0.5665000    
 H    3.580400       3.172100      -1.655600    
 H    6.106400       1.539000      -1.097600    
 H   -3.946900       3.410200     -0.5509000    
 H   -5.648100       3.115100     -0.4300000    


%chk=000124908-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124908

0 1
P 3.936193 1.776041 -0.065140
O 1.217274 -0.613485 0.952208
O -1.007510 -3.145170 -0.509321
O 1.142801 -3.822552 0.812000
O 4.010908 0.078013 0.146230
O -3.007925 -1.364651 0.107809
O 2.440207 2.377174 0.562960
O 3.504860 1.825762 -1.722729
O 5.232331 2.500851 0.466023
O -5.212206 0.805887 -0.763346
N -0.984225 -0.005311 0.251920
N -1.766608 2.053839 -0.229111
N -4.275561 2.946549 -0.878366
C 0.068294 -2.162117 -0.494011
C 1.451486 -2.772403 -0.170674
C -0.120903 -1.117778 0.646582
C 2.233836 -1.581199 0.442164
C 3.139735 -0.876799 -0.573939
C -2.368811 -0.157529 -0.006034
C -0.670034 1.355777 0.093578
C -2.839774 1.130115 -0.298549
C -4.209129 1.577742 -0.659263
H 0.066566 -1.659310 -1.474451
H 1.949892 -3.202078 -1.059840
H -0.554932 -1.619053 1.537159
H 2.842034 -1.906363 1.306091
H 2.561621 -0.360170 -1.360403
H 3.836704 -1.598575 -1.038555
H -0.737370 -3.876469 0.115096
H 1.923096 -4.402787 0.982949
H 0.340199 1.738975 0.220453
H -2.436703 -2.148564 -0.179883
H 2.452226 2.622524 1.523224
H 3.139485 2.685694 -2.049224
H -3.426794 3.505880 -0.777691
H -5.168364 3.363539 -1.130915


