%chk=000081702.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081702

0 1
 P    1.940600     -0.3421000     -0.4905000    
 O    2.079800      0.9239000      0.4937000    
 O   0.7319000      -1.184600      0.1510000    
 O    1.851100     -3.6100000E-02  -1.944900    
 O   -4.892900       1.501300     -0.5818000    
 O   -5.471200     -0.3099000      0.5157000    
 N   -4.600000      0.4207000     -1.5200000E-02
 C    3.391900      -1.372400     -0.1113000    
 C    3.202400       1.786200      0.4461000    
 C    3.325900      -2.696800     -0.8594000    
 C    3.516500      -1.601000       1.389100    
 C    3.295600       2.411000     -0.9377000    
 C    3.071500       2.839500       1.535700    
 C  -0.5784000     -0.7903000      0.1102000    
 C  -0.9194000      0.4045000     -0.5152000    
 C   -1.557500      -1.587500      0.6939000    
 C   -2.254400      0.8067000     -0.5572000    
 C   -2.892500      -1.185200      0.6517000    
 C   -3.240800      1.1900000E-02  2.6200000E-02
 H    4.278500     -0.8306000     -0.4593000    
 H    4.113600       1.213300      0.6420000    
 H    4.216900      -3.302900     -0.6675000    
 H    2.445300      -3.275300     -0.5619000    
 H    3.256300      -2.524900      -1.938200    
 H    4.409000      -2.192600       1.618200    
 H    2.646600      -2.138300       1.780400    
 H    3.592100     -0.6602000       1.940000    
 H    4.022700       3.229600     -0.9513000    
 H    3.627900       1.679700      -1.680000    
 H    2.325500       2.799300      -1.265900    
 H    3.932200       3.514900       1.545100    
 H    2.990300       2.362400       2.518400    
 H    2.160600       3.432400       1.397700    
 H  -0.1911000       1.063600     -0.9724000    
 H   -1.289800      -2.520400       1.181900    
 H   -2.489200       1.746600      -1.050300    
 H   -3.633900      -1.829900       1.117000    


%chk=000081702-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081702

0 1
P 2.484631 -0.454435 -0.395174
O 3.066736 0.786754 0.653692
O 0.946583 -0.982574 0.339809
O 2.359657 -0.024180 -1.927438
O -4.663951 1.075827 -1.946119
O -5.261223 0.390076 0.147341
N -4.385487 0.572006 -0.787758
C 3.553166 -1.930031 0.074395
C 2.918602 2.239748 0.263328
C 3.096975 -3.162052 -0.737185
C 3.551344 -2.161214 1.599678
C 1.528048 2.741678 0.672238
C 4.068327 2.948143 0.983865
C -0.341074 -0.550609 -0.000906
C -0.678828 -0.006024 -1.270176
C -1.327694 -0.726690 1.003900
C -2.012415 0.363316 -1.522122
C -2.659092 -0.362844 0.747488
C -2.987698 0.183287 -0.515615
H 4.563162 -1.617676 -0.256058
H 3.045295 2.297953 -0.835671
H 3.790786 -3.998900 -0.540238
H 2.082755 -3.479059 -0.437499
H 3.096515 -2.964142 -1.823460
H 4.249308 -2.984946 1.836952
H 2.546087 -2.445799 1.953332
H 3.873904 -1.261246 2.149236
H 1.438083 3.821411 0.452529
H 0.728327 2.218098 0.119473
H 1.366978 2.590724 1.754073
H 4.053971 4.026905 0.743878
H 5.041404 2.532394 0.672897
H 3.968958 2.831282 2.077192
H 0.093230 0.111294 -2.036228
H -1.028565 -1.147837 1.967587
H -2.310653 0.782663 -2.486650
H -3.442550 -0.486802 1.499414


