%chk=000089579.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089579

0 1
 O    1.016200      -1.563300      -1.583000    
 O   -1.016200      -1.564400       1.581900    
 O   0.4867000       1.853800       1.795600    
 O  -0.4866000       1.855100      -1.794300    
 O    3.745800      -1.395300      -1.047100    
 O   -3.745800      -1.396100       1.046200    
 N    1.288400       1.002700       1.041700    
 N   -1.288400       1.003500      -1.041000    
 C   0.7184000      0.1392000      9.5700003E-02
 C  -0.7185000      0.1393000     -9.5700003E-02
 C    1.507200     -0.6902000     -0.6365000    
 C   -1.507200     -0.6907000      0.6361000    
 C    2.992500     -0.6632000     -0.4130000    
 C   -2.992500     -0.6635000      0.4127000    
 C    2.647400       1.038800       1.253400    
 C   -2.647300       1.039700      -1.252700    
 C    3.528800      0.2769000      0.6014000    
 C   -3.528700      0.2774000     -0.6012000    
 H    2.963900       1.748900       2.009000    
 H   -2.963900       1.750300      -2.007800    
 H    4.594400      0.3201000      0.7832000    
 H   -4.594200      0.3206000     -0.7830000    
 H   5.2900001E-02  -1.469400      -1.653000    
 H   -1.775200      -2.040700       1.960700    
 H   0.4442000       2.643900       1.229600    
 H  -0.2808000       1.304200      -2.569500    


%chk=000089579-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089579

0 1
O 1.035370 -2.188327 -0.653765
O -1.142256 -2.093199 0.775543
O 0.607969 2.257309 1.318936
O -0.569066 2.393875 -1.098089
O 3.783384 -1.915137 -0.496745
O -3.702195 -1.908220 0.441731
N 1.387026 1.293798 0.567024
N -1.356638 1.257136 -0.686888
C 0.747757 0.118017 0.102339
C -0.715172 0.143927 -0.083554
C 1.550368 -0.999770 -0.203096
C -1.586372 -0.893567 0.229566
C 3.050595 -0.931871 -0.150531
C -3.049443 -0.856443 0.060456
C 2.753840 1.379668 0.729523
C -2.718050 1.386655 -0.861901
C 3.576416 0.339865 0.345637
C -3.581079 0.365475 -0.495148
H 3.106241 2.309587 1.179560
H -3.040685 2.330191 -1.305315
H 4.660391 0.439110 0.442196
H -4.657011 0.479838 -0.640100
H 0.169438 -2.423516 -0.179420
H -2.006453 -2.618733 0.929570
H 0.177646 2.809018 0.596367
H -0.040521 2.102916 -1.894496


