%chk=000101609.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101609

0 1
 P   -2.900900       1.716300     -0.5891000    
 O   3.1399999E-02  -1.889900      0.9922000    
 O   -1.611400       1.210600      0.2527000    
 O   -2.792600     -0.9664000       1.394500    
 O   5.8300000E-02  -4.160900     -0.6539000    
 O   -2.329700       1.899300      -2.090900    
 O   -3.096100       3.237800     -7.7500001E-02
 O    1.284400       1.960100       1.694200    
 O   -4.116900      0.8454000     -0.4669000    
 O    4.995000       1.101900     -0.9020000    
 N    1.333700     -2.3000000E-02  0.4599000    
 N    3.131100       1.531300      0.4002000    
 C   -1.071400     -6.2399998E-02 -3.6899999E-02
 C   -2.075300      -1.175200      0.1782000    
 C   4.3699998E-02 -0.4550000      0.9169000    
 C   -1.172800      -2.386700      0.3679000    
 C  -0.7851000      -3.059600     -0.9420000    
 C    1.866600       1.207700      0.9101000    
 C    2.057400     -0.8146000     -0.4244000    
 C    3.261500     -0.4928000     -0.9017000    
 C    3.888900      0.7763000     -0.4815000    
 H  -0.7197000     -7.0299998E-02  -1.075800    
 H   -2.798700      -1.299300     -0.6309000    
 H  -0.1338000     -5.9200000E-02   1.924000    
 H   -1.603000      -3.124700       1.054600    
 H  -0.2578000      -2.387200      -1.623100    
 H   -1.677700      -3.436100      -1.452100    
 H   -2.166700     -0.9759000       2.137600    
 H    1.618600      -1.748300     -0.7425000    
 H   0.2820000      -4.580400      -1.502100    
 H    3.533400       2.411400      0.7102000    
 H    3.797000      -1.135700      -1.589600    
 H   -2.953900       2.131800      -2.810900    
 H   -3.882500       3.741800     -0.3769000    


%chk=000101609-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101609

0 1
P -2.384001 2.036712 -0.814334
O 0.045298 -1.963897 1.176962
O -2.132077 0.822672 0.377507
O -2.918878 -1.446841 1.635252
O 0.536244 -4.074611 -0.551327
O -0.748265 2.332101 -1.208695
O -2.823969 3.354245 0.178053
O 0.975836 1.973114 1.608978
O -3.372980 1.702642 -2.009175
O 4.432389 1.628500 -1.525030
N 1.141184 -0.010808 0.339473
N 2.687624 1.747733 0.025977
C -1.360467 -0.386577 0.036465
C -2.205418 -1.639564 0.381770
C -0.106428 -0.527861 0.947918
C -1.114314 -2.703814 0.594900
C -0.751757 -3.402205 -0.729824
C 1.561007 1.294586 0.725606
C 1.875136 -0.790362 -0.554519
C 2.984017 -0.308343 -1.205306
C 3.452466 1.055926 -0.967267
H -1.069582 -0.381481 -1.030102
H -2.908441 -1.894263 -0.437937
H -0.256338 0.019139 1.893974
H -1.409003 -3.440922 1.357757
H -0.691943 -2.668037 -1.564690
H -1.564548 -4.122405 -0.963177
H -3.243065 -0.507207 1.661373
H 1.541353 -1.829473 -0.647309
H 0.666792 -4.740486 -1.272021
H 3.005553 2.690732 0.271799
H 3.557449 -0.936007 -1.887659
H -0.582156 2.980629 -1.938466
H -3.781721 3.604533 0.115576


