%chk=000161568.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161568

0 1
 P  -0.3021000      0.2606000     -0.6793000    
 O  -0.8484000     -0.9161000      0.2983000    
 O   -1.116700       1.538900     -9.0000004E-02
 O  -0.6239000     -2.7999999E-03  -2.127000    
 C   -1.221100      -3.286300      0.6004000    
 C  -0.2135000      -2.187100      0.2528000    
 C   -2.382200      -3.313400     -0.3959000    
 C  -0.5301000      -4.647300      0.6470000    
 C    1.384800      0.5150000     -0.2367000    
 C    2.381700      0.4699000      -1.214100    
 C    1.730500      0.7622000       1.093900    
 C    3.716500      0.6712000     -0.8631000    
 C    3.065300      0.9635000       1.445000    
 C    4.058400      0.9181000      0.4665000    
 C   -2.517400       1.607600     -0.2971000    
 C   -3.065300       2.824200      0.3037000    
 C   -3.516700       3.821700      0.7958000    
 H   -1.643700      -3.071100       1.590100    
 H   0.6078000      -2.183300      0.9770000    
 H   0.2098000      -2.357400     -0.7440000    
 H   -3.094900      -4.104400     -0.1393000    
 H   -2.025500      -3.496500      -1.415200    
 H   -2.927600      -2.364000     -0.3937000    
 H   -1.238500      -5.434000      0.9271000    
 H   0.2782000      -4.647600       1.385900    
 H  -0.1002000      -4.909200     -0.3258000    
 H    2.126600      0.2779000      -2.252200    
 H   0.9635000      0.7990000       1.862300    
 H    4.489800      0.6356000      -1.624900    
 H    3.331500       1.155400       2.480200    
 H    5.097800       1.074700      0.7399000    
 H   -2.717800       1.598400      -1.373300    
 H   -2.987800      0.7238000      0.1454000    
 H   -3.917000       4.706700       1.232300    


%chk=000161568-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161568

0 1
P 0.037876 0.156993 -0.769957
O -0.539103 -1.149155 0.239696
O -0.963914 1.422490 -0.131306
O -0.058434 -0.156327 -2.332067
C -1.251193 -3.457992 0.604529
C -0.354795 -2.544598 -0.246831
C -2.746060 -3.115605 0.422399
C -0.958322 -4.934189 0.240285
C 1.694320 0.679271 -0.158135
C 2.754842 0.729954 -1.091922
C 1.895512 1.008325 1.202352
C 4.041226 1.113519 -0.651651
C 3.184534 1.393424 1.630880
C 4.255416 1.444213 0.706638
C -2.428171 1.326886 -0.412645
C -3.068732 2.554668 0.061075
C -3.647978 3.570420 0.449228
H -0.976892 -3.293186 1.665804
H 0.711660 -2.823569 -0.129379
H -0.627200 -2.598268 -1.319524
H -3.376231 -3.750582 1.071673
H -3.061272 -3.282032 -0.626014
H -2.939333 -2.059697 0.679707
H -1.577849 -5.613036 0.853624
H 0.102798 -5.195897 0.411522
H -1.193038 -5.133784 -0.822867
H 2.566629 0.477529 -2.141382
H 1.059692 0.972129 1.907975
H 4.870098 1.157411 -1.365977
H 3.352755 1.655546 2.680754
H 5.253813 1.743570 1.044509
H -2.582113 1.200127 -1.502409
H -2.835588 0.442681 0.114221
H -4.143155 4.462660 0.787193


