%chk=000089370.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089370

0 1
 P    3.865400      -2.020500      -1.062400    
 P   -3.867600       2.021400      -1.059300    
 O    5.377100      -1.604200      -1.462200    
 O    3.266100      -2.568700      -2.462400    
 O   -5.379900       1.605200      -1.456800    
 O   -3.270900       2.571100      -2.459900    
 O    3.761700      -2.980200      8.6199999E-02
 O   -3.761900       2.979900      9.0099998E-02
 O    4.184900       2.172300      -1.154800    
 O   -4.186400      -2.171400      -1.155400    
 N    1.651500     -0.8576000     -0.7431000    
 N   -1.655000      0.8610000     -0.7450000    
 C    3.049100     -0.4304000     -0.8393000    
 C   -3.050500      0.4312000     -0.8394000    
 C   0.7172000      0.2584000     -0.7536000    
 C  -0.7187000     -0.2576000     -0.7526000    
 C    3.541800      0.3999000      0.3248000    
 C   -3.540900     -0.4004000      0.3249000    
 C    4.082300       1.655500      0.1017000    
 C   -4.081700      -1.655900      0.1014000    
 C    3.438600     -0.1244000       1.603300    
 C   -3.435500      0.1227000       1.603600    
 C    4.532100       2.408100       1.186800    
 C   -4.529200      -2.409500       1.186600    
 C    3.888500      0.6281000       2.688200    
 C   -3.883200     -0.6311000       2.688600    
 C    4.435200       1.894300       2.480000    
 C   -4.430100      -1.897100       2.480100    
 H    3.181200      0.1041000      -1.786700    
 H   -3.161400     -8.7300003E-02  -1.795200    
 H   0.8783000      0.8728000      -1.648400    
 H   0.8677000      0.8991000      0.1236000    
 H  -0.8696000     -0.8952000      0.1268000    
 H  -0.8807000     -0.8742000      -1.645600    
 H    1.505500      -1.430000      8.7300003E-02
 H   -1.508500       1.433800      8.5100003E-02
 H    3.011400      -1.103700       1.792100    
 H   -3.008100       1.102000       1.792700    
 H    4.960100       3.396000       1.039400    
 H   -4.956300      -3.396600       1.031200    
 H    3.811700      0.2289000       3.695400    
 H   -3.804600     -0.2329000       3.696000    
 H    6.040600      -2.311700      -1.608400    
 H    3.551200      -3.449200      -2.787300    
 H   -6.043800       2.312600      -1.601100    
 H   -3.556900       3.451800      -2.783500    
 H    4.785000       2.480200       3.324800    
 H   -4.778300      -2.484000       3.325100    
 H    4.586400       3.056600      -1.102600    
 H   -4.487800      -1.472600      -1.759000    


%chk=000089370-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089370

0 1
P 3.045878 -0.597982 -2.036087
P -2.272342 0.117762 -1.556970
O 3.385385 0.788569 -3.021141
O 1.393601 -1.061393 -2.522951
O -3.684296 -0.257312 -2.565243
O -1.178515 -0.970816 -2.319088
O 3.989903 -1.865238 -2.294746
O -1.778065 1.637571 -1.530062
O 3.319924 2.753949 0.840161
O -5.358991 -1.664765 -1.175914
N 1.866328 -0.441680 0.553912
N -1.880194 -0.762795 1.144653
C 2.759566 0.286588 -0.285434
C -2.884649 -0.825503 0.131034
C 0.477174 -0.015522 0.763666
C -0.499089 -1.216328 0.918002
C 4.124244 0.546725 0.332152
C -4.244583 -0.315935 0.565970
C 4.363193 1.816269 0.926292
C -5.424513 -0.829341 -0.060824
C 5.136533 -0.440425 0.413237
C -4.402486 0.607004 1.632147
C 5.586748 2.096032 1.575315
C -6.703170 -0.515562 0.457665
C 6.359653 -0.172647 1.068980
C -5.678344 0.950848 2.123882
C 6.582592 1.096897 1.646909
C -6.831683 0.364090 1.549928
H 2.308040 1.239985 -0.607853
H -2.973565 -1.842185 -0.292872
H 0.166100 0.611818 -0.090756
H 0.388386 0.628773 1.669140
H -0.169946 -1.848878 1.768340
H -0.467575 -1.841693 0.009437
H 2.289549 -1.052146 1.254418
H -1.989254 -0.028261 1.844962
H 4.979079 -1.412569 -0.068887
H -3.528016 1.077682 2.098461
H 5.761514 3.083076 2.022543
H -7.576185 -0.955898 -0.033415
H 7.134913 -0.943629 1.115425
H -5.772182 1.664992 2.948509
H 3.805331 0.593350 -3.897874
H 1.405460 -1.956946 -2.951246
H -3.604161 -0.057698 -3.529813
H -0.177718 -0.765601 -2.360455
H 7.530235 1.315725 2.150547
H -7.826426 0.610403 1.937487
H 3.590965 3.632191 1.204244
H -4.721249 -1.260952 -1.863988


