%chk=000178959.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178959

0 1
 O   -2.715100       1.126600     -0.8151000    
 O    3.512900      0.1474000      0.4942000    
 O    2.163500       1.717200     -0.5315000    
 C   0.7014000      -1.295900     -0.1023000    
 C  -0.1102000     -4.6599999E-02 -1.5200000E-02
 C    1.216000     -0.1145000      0.6664000    
 C   -1.348600     -1.2700000E-02  0.8336000    
 C   0.2896000      -2.498700      0.6769000    
 C    1.302600      -1.621700      -1.427400    
 C   -2.667400     -2.1400001E-02  3.5700001E-02
 C    2.320700      0.7016000      0.1326000    
 C   -3.905400      1.3800000E-02  0.9329000    
 C   -2.719000      -1.264200     -0.8604000    
 C   -2.718400       2.326200     -5.8899999E-02
 C    4.677500      0.8429000      3.8400002E-02
 H  -0.1897000      0.5924000     -0.8868000    
 H    1.207500     -0.1815000       1.751000    
 H   -1.281600      0.8656000       1.484400    
 H   -1.386500     -0.8458000       1.542500    
 H   0.1100000      -2.296200       1.737500    
 H  -0.6035000      -2.963400      0.2509000    
 H    1.086800      -3.251400      0.6495000    
 H    2.261000      -2.136500      -1.299300    
 H   0.6392000      -2.282300      -1.996500    
 H    1.480400     -0.7362000      -2.047400    
 H   -4.075400     -0.9659000       1.395000    
 H   -3.804100      0.7203000       1.763500    
 H   -4.806000      0.2828000      0.3692000    
 H   -2.686900      -2.189000     -0.2772000    
 H   -3.647200      -1.269700      -1.445000    
 H   -1.909700      -1.273400      -1.597500    
 H   -1.776600       2.512500      0.4610000    
 H   -3.576800       2.432200      0.6074000    
 H   -2.812100       3.142900     -0.7840000    
 H    4.698600      0.8691000      -1.055200    
 H    5.558000      0.3009000      0.3936000    
 H    4.699100       1.856400      0.4503000    


%chk=000178959-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178959

0 1
O -2.685293 1.085662 -0.810869
O 3.435733 0.579928 0.958202
O 2.475019 1.017652 -1.122678
C 0.634692 -1.512038 -0.345001
C -0.118121 -0.216912 -0.031336
C 1.316829 -0.391446 0.525429
C -1.300479 -0.091262 0.921603
C 0.306633 -2.804563 0.402275
C 1.104922 -1.736196 -1.780483
C -2.679331 -0.018542 0.196696
C 2.411418 0.456439 0.001251
C -3.815645 0.174205 1.227012
C -2.938891 -1.262790 -0.672244
C -2.509251 2.444757 -0.300267
C 4.590807 1.410186 0.544533
H -0.170154 0.476802 -0.881507
H 1.418271 -0.632569 1.588331
H -1.172880 0.821035 1.539134
H -1.332183 -0.939655 1.631700
H -0.000477 -2.627194 1.448076
H -0.513533 -3.345848 -0.106900
H 1.189898 -3.469732 0.421133
H 1.977094 -2.416718 -1.810364
H 0.293152 -2.201795 -2.371794
H 1.391911 -0.790008 -2.268010
H -3.920339 -0.730089 1.853860
H -3.624468 1.028205 1.902132
H -4.773745 0.345796 0.705079
H -2.927773 -2.180444 -0.057005
H -3.922339 -1.176116 -1.165595
H -2.168751 -1.349145 -1.456552
H -1.533271 2.585193 0.208551
H -3.322810 2.745002 0.390855
H -2.540092 3.093273 -1.190660
H 5.079899 0.973310 -0.342678
H 5.265914 1.404065 1.412054
H 4.262233 2.435350 0.302835


