%chk=000081979.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081979

0 1
 O    1.083000       1.360000      -1.926400    
 O    2.356800       2.109300     -0.1909000    
 O   -4.490800      0.1090000      0.3326000    
 C    1.182000     -1.3800000E-02 -4.9000001E-03
 C    1.793300     -7.6399997E-02   1.420700    
 C    1.735500      -1.195100     -0.8466000    
 C    3.317200     -0.2189000       1.437600    
 C    3.261500      -1.305100     -0.8257000    
 C    3.792100      -1.395300      0.5977000    
 C  -0.3547000      1.9700000E-02  8.6900003E-02
 C    1.621300       1.268100     -0.6857000    
 C  -0.9836000       1.045300      0.7864000    
 C   -1.105000     -0.9761000     -0.5312000    
 C   -2.375600       1.075300      0.8689000    
 C   -2.497100     -0.9460000     -0.4489000    
 C   -3.132500      7.9700001E-02  0.2512000    
 C   -5.203300     -0.9396000     -0.3217000    
 H    1.360400     -0.9311000       1.959300    
 H    1.534000      0.8138000       2.007500    
 H    1.410800      -1.136600      -1.893400    
 H    1.351000      -2.144200     -0.4482000    
 H    3.647600     -0.3638000       2.473400    
 H    3.806700      0.6975000       1.093500    
 H    3.708500     -0.4435000      -1.335500    
 H    3.569400      -2.195700      -1.385800    
 H    4.887400      -1.423000      0.5843000    
 H    3.455300      -2.333100       1.056500    
 H  -0.4157000       1.835700       1.268500    
 H  -0.6663000      -1.791300      -1.094600    
 H   -2.865100       1.877700       1.414200    
 H   -3.024500      -1.748800     -0.9529000    
 H    1.354700       2.184200      -2.383300    
 H   -6.270200     -0.7589000     -0.1544000    
 H   -4.972200      -1.917000      0.1154000    
 H   -5.042000     -0.9208000      -1.405000    


%chk=000081979-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081979

0 1
O 1.589658 1.275372 -2.053247
O 1.878533 2.357919 -0.033023
O -4.563456 0.147724 0.384890
C 1.224925 -0.052024 -0.023762
C 1.804269 -0.127086 1.427678
C 1.792286 -1.233981 -0.861560
C 3.348596 -0.201644 1.460436
C 3.337339 -1.281641 -0.845473
C 3.884710 -1.367613 0.598283
C -0.327763 -0.041914 0.032900
C 1.613329 1.300809 -0.650217
C -0.995964 1.001823 0.734845
C -1.121695 -1.040846 -0.574659
C -2.395932 1.037924 0.832930
C -2.533642 -1.023764 -0.481986
C -3.174309 0.020027 0.226327
C -5.409649 -0.873722 -0.235728
H 1.374205 -1.031969 1.901282
H 1.460458 0.744023 2.012337
H 1.426153 -1.172305 -1.901215
H 1.406812 -2.175366 -0.420437
H 3.683471 -0.314930 2.509589
H 3.768393 0.756933 1.097172
H 3.742575 -0.378970 -1.345762
H 3.681318 -2.150627 -1.439025
H 4.991738 -1.360750 0.590366
H 3.571558 -2.332608 1.048780
H -0.412493 1.806336 1.197170
H -0.652073 -1.852359 -1.137411
H -2.908894 1.842640 1.368422
H -3.110221 -1.819041 -0.964377
H 1.774558 2.194346 -2.389514
H -6.441194 -0.580079 0.008356
H -5.200013 -1.878591 0.180380
H -5.277686 -0.892847 -1.335246


