%chk=000122664.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122664

0 1
 P    4.097000      0.1802000     -1.7800000E-02
 P    2.420100      -2.168300     -0.5995000    
 P   9.9600002E-02  -2.242900       1.220900    
 O   0.3567000       3.333900      -1.214600    
 O    2.982300       1.312900      0.2863000    
 O  -0.9206000       2.511700       2.766900    
 O    3.339900     -0.8914000     -0.9604000    
 O    5.133000      0.8980000      -1.032100    
 O    4.737100     -0.4175000       1.201300    
 O   -3.834900      -2.116400      -1.931100    
 O    1.283700      -1.548900      0.3677000    
 O    3.340000      -3.035700      0.4077000    
 O    1.889400      -2.927800      -1.779500    
 O   0.9028000      -3.107400       2.325500    
 O  -0.5188000      -1.019600       2.076800    
 O  -0.8903000      -3.017600      0.4017000    
 N   -1.343800       1.549900      -1.043700    
 N   -2.828800      0.7854000      0.7243000    
 N   -1.853100     -2.5500000E-02  -2.559100    
 N   -4.111400      -1.166300      0.1647000    
 N   -4.303900     -0.1082000       2.262500    
 C   0.2477000       2.378400      0.6909000    
 C  -0.7050000       2.719600     -0.4492000    
 C    1.329800       2.956300     -0.2142000    
 C   0.1172000       3.115100       2.006300    
 C    2.308900       1.949600     -0.7863000    
 C   -2.269600      0.7348000     -0.4875000    
 C   -1.122000       1.047100      -2.306300    
 C   -2.573500     -0.2193000      -1.414200    
 C   -3.546300      -1.250700      -1.113800    
 C   -3.763100     -0.2096000       1.005700    
 H   0.3732000       1.302500      0.8696000    
 H   -1.456200       3.477300     -0.1914000    
 H    1.836000       3.844700      0.1832000    
 H    1.044200       3.039000       2.583900    
 H  -0.1210000       4.174100       1.861800    
 H    3.037200       2.453200      -1.429600    
 H    1.795800       1.186500      -1.379900    
 H  -0.4224000       1.499900      -2.995600    
 H  -0.9781000       2.997500       3.607300    
 H   -2.604100       1.493500       1.415500    
 H    5.970800      0.4399000      -1.256900    
 H   -4.996600     -0.7722000       2.590800    
 H   -4.026400      0.6302000       2.900000    
 H    3.019700      -3.913600      0.7056000    
 H   0.3996000      -3.705200       2.918400    
 H   -1.319000      -1.177100       2.621700    


%chk=000122664-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122664

0 1
P 2.597335 0.094954 0.796420
P 3.043472 -1.904037 -1.559274
P 0.599662 -4.007535 -1.709380
O 0.594687 2.219765 -1.430319
O 3.106193 1.741319 0.812473
O -1.316903 3.776646 2.237847
O 2.733735 -0.308626 -0.893443
O 3.885563 -0.694519 1.547853
O 1.148925 -0.086156 1.421711
O -3.765950 -2.524297 1.406980
O 1.449108 -2.402374 -1.870954
O 3.424834 -2.712407 -0.083495
O 4.106134 -1.867827 -2.717093
O 1.722003 -4.507954 -0.373285
O -0.806318 -3.565703 -1.090693
O 0.804254 -4.976483 -2.941748
N -1.119129 0.962539 -0.251245
N -2.861510 1.557455 1.436620
N -1.503441 -1.223827 -0.339870
N -4.223611 -0.331095 2.152204
N -4.616550 1.817239 2.995203
C 0.356119 2.931033 0.628277
C -0.536556 2.291126 -0.482429
C 1.424703 3.116392 -0.501666
C -0.206037 4.167425 1.325990
C 2.869556 2.632819 -0.343328
C -2.168055 0.682946 0.624438
C -0.717111 -0.236058 -0.811409
C -2.427953 -0.686883 0.566833
C -3.499051 -1.294339 1.384663
C -3.908994 0.957265 2.181160
H 0.679754 2.166851 1.356240
H -1.343970 2.959435 -0.847185
H 1.431993 4.136468 -0.934461
H 0.578156 4.696425 1.899380
H -0.659972 4.876744 0.612346
H 3.538791 3.483652 -0.135414
H 3.180910 2.135942 -1.281914
H 0.116786 -0.356227 -1.495892
H -0.943922 3.502827 3.112870
H -2.454868 2.485573 1.689271
H 3.955577 -1.646901 1.177321
H -5.356822 1.400226 3.555696
H -4.545475 2.829305 2.920126
H 2.830477 -3.586309 -0.009434
H 1.672963 -5.460878 -0.123225
H -1.316691 -2.271935 -0.610466


