%chk=000224767.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224767

0 1
P -0.867434 -1.770015 0.410937
O -1.991206 -1.236881 1.509578
O -0.619206 -0.432234 -0.537320
O -1.298792 -2.984037 -0.314745
O 2.513172 0.122139 0.715813
O 2.807162 -0.831785 -1.312682
C 0.706515 -1.867438 1.434996
C 1.901437 -2.154049 0.530142
C 0.459747 -2.983211 2.440719
C -2.068308 0.187678 1.759372
C -1.147042 -0.511046 -1.898607
C -3.214288 0.759704 0.922992
C 0.028535 -0.291790 -2.844206
C 2.434753 -0.927402 -0.164715
C -3.557208 2.189135 1.356128
C 0.429122 1.184970 -2.952363
C 2.926804 1.425969 0.183587
C 2.084534 2.456552 0.925266
C -4.717111 2.759562 0.545415
C 1.783919 1.344033 -3.635626
C 0.601536 2.386475 0.543479
C -0.178748 3.585146 1.069433
H 0.875388 -0.899286 1.975268
H 1.687851 -2.940510 -0.232453
H 2.730223 -2.585067 1.142477
H 1.313745 -3.091505 3.124127
H -0.420008 -2.792725 3.076526
H 0.312811 -3.967601 1.967821
H -1.102673 0.706904 1.557225
H -2.288958 0.220538 2.844994
H -1.890096 0.308992 -1.935946
H -1.650888 -1.480905 -2.093997
H -2.949957 0.742256 -0.153310
H -4.099663 0.097753 1.019218
H 0.904516 -0.885725 -2.493861
H -0.215385 -0.697207 -3.845076
H -2.659183 2.842660 1.235353
H -3.809658 2.210660 2.434412
H 0.469894 1.630993 -1.927503
H -0.345304 1.752103 -3.501537
H 2.775202 1.440603 -0.913040
H 4.002114 1.501785 0.416646
H 2.194160 2.308833 2.019092
H 2.488473 3.467021 0.711923
H -5.626174 2.157244 0.662702
H -4.958955 3.780484 0.862295
H -4.485975 2.794085 -0.525482
H 1.761717 0.980353 -4.668900
H 2.102513 2.390252 -3.659862
H 2.560647 0.765235 -3.110331
H 0.157478 1.438710 0.932744
H 0.490398 2.306236 -0.566267
H 0.094190 4.508982 0.547680
H -1.266128 3.439127 0.933976
H -0.004305 3.749145 2.138595


%chk=000224767-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224767

0 1
P -1.097499 -0.693426 0.172767
O -1.755125 0.528961 1.219843
O -0.188676 0.160567 -1.041153
O -2.171246 -1.700388 -0.455853
O 2.617796 0.016400 0.752512
O 2.993991 -1.245806 -1.171074
C 0.222390 -1.388483 1.321858
C 1.378450 -2.032823 0.520756
C -0.463128 -2.391698 2.276574
C -3.091299 1.110007 0.906621
C -0.680783 0.151818 -2.456981
C -4.224427 0.279411 1.523063
C 0.543105 0.088509 -3.373884
C 2.388193 -1.066648 -0.089703
C -5.606592 0.938986 1.301194
C 1.426213 1.354625 -3.308083
C 3.611612 1.038409 0.297844
C 3.357056 2.312153 1.105628
C -6.753933 0.119016 1.930286
C 2.752379 1.184851 -4.078590
C 2.007044 2.992987 0.783351
C 1.775560 4.264497 1.626637
H 0.602499 -0.516958 1.879430
H 1.010570 -2.689225 -0.286924
H 1.943633 -2.680713 1.221478
H 0.275368 -2.767300 3.008111
H -1.287025 -1.915190 2.835683
H -0.878415 -3.252031 1.722416
H -3.220128 1.199411 -0.191087
H -3.046251 2.123356 1.343301
H -1.254934 1.086185 -2.612036
H -1.350557 -0.718416 -2.595085
H -4.211924 -0.733206 1.077333
H -4.035189 0.168476 2.608888
H 1.145928 -0.798630 -3.102332
H 0.185178 -0.065551 -4.413529
H -5.790516 1.053452 0.213407
H -5.604424 1.962202 1.729851
H 1.636051 1.579884 -2.245395
H 0.859673 2.220451 -3.709450
H 3.480275 1.191972 -0.788282
H 4.620144 0.621355 0.475702
H 3.410857 2.074336 2.186402
H 4.188802 3.015736 0.893790
H -6.613621 0.014272 3.022612
H -7.734421 0.599941 1.759239
H -6.794268 -0.898015 1.498029
H 2.568893 0.938511 -5.142015
H 3.360670 2.108186 -4.048836
H 3.348777 0.364620 -3.637857
H 1.183116 2.274623 0.951779
H 1.978848 3.250054 -0.295241
H 2.574042 5.011904 1.455707
H 0.809288 4.739371 1.377080
H 1.763883 4.026910 2.707318


