%chk=000147690.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147690

0 1
 P   1.0500000E-02 -0.3806000     -0.5347000    
 O   0.2894000     -0.7392000      -1.982900    
 O    3.710400      0.7799000      0.2212000    
 O   -3.170700       1.635100      0.6237000    
 N    1.395500      0.1188000      0.2723000    
 N   -1.139100      0.8347000     -0.3938000    
 N  -0.5885000      -1.717900      0.3077000    
 C    2.432500      0.9093000     -0.3983000    
 C   -1.896100       1.035900      0.8441000    
 C    1.275200      0.5287000       1.672500    
 C  -0.8737000       2.122000      -1.038200    
 C   -1.812800      -2.338600     -0.2151000    
 C   0.3675000      -2.788000      0.6216000    
 H    2.159600       1.969300     -0.4271000    
 H    2.546100      0.5624000      -1.429800    
 H   -1.347800       1.672900       1.544500    
 H   -2.088000      9.1499999E-02   1.358300    
 H   0.9680000       1.575600       1.756900    
 H    2.222400      0.4022000       2.207600    
 H   0.5432000     -8.5500002E-02   2.205500    
 H  -0.2011000       2.738300     -0.4336000    
 H   -1.795600       2.682700      -1.223500    
 H  -0.4032000       1.966100      -2.014400    
 H   -1.623500      -2.848600      -1.165700    
 H   -2.586900      -1.585300     -0.3891000    
 H   -2.227700      -3.058200      0.4988000    
 H  -8.4799998E-02  -3.547600       1.268800    
 H    1.231400      -2.395900       1.165500    
 H   0.7313000      -3.271700     -0.2911000    
 H    4.330900       1.326800     -0.2901000    
 H   -3.606900       1.111800     -7.0100002E-02


%chk=000147690-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000147690

0 1
P 0.124167 0.068281 -0.589072
O 0.531068 0.088702 -2.142033
O 3.604895 -0.693498 0.049143
O -3.520664 0.795944 0.564867
N 1.506226 0.565605 0.377151
N -1.236447 1.116043 -0.247233
N -0.412201 -1.445299 0.132775
C 2.827860 0.537117 -0.230656
C -2.106497 0.999790 0.917630
C 1.389208 0.868319 1.813355
C -1.430379 2.300835 -1.114018
C -1.580367 -2.110931 -0.485750
C 0.576751 -2.390839 0.690409
H 3.438685 1.338545 0.216311
H 2.710304 0.684884 -1.319264
H -2.137980 1.950625 1.481089
H -1.730781 0.178149 1.555583
H 0.383592 1.263761 2.039776
H 2.124189 1.650906 2.077165
H 1.577370 -0.010824 2.461377
H -1.017318 3.220238 -0.652388
H -2.510799 2.441080 -1.289928
H -0.932844 2.126841 -2.082723
H -1.270802 -2.887715 -1.215928
H -2.196776 -1.374842 -1.030903
H -2.197751 -2.593870 0.296327
H 0.120529 -2.935369 1.538716
H 1.468341 -1.854270 1.053861
H 0.904293 -3.139330 -0.063874
H 3.373492 -1.378062 -0.628756
H -3.611863 -0.073913 0.098493


