%chk=000027125.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027125

0 1
 O   -4.562000      -1.789200      0.3572000    
 O   -2.712300       2.577200     -0.3548000    
 O   -4.888500       1.149200     -0.8241000    
 O    6.247700      0.1132000      0.3114000    
 C   -2.218700      -1.003700      0.2232000    
 C   -1.673700      0.3777000     -0.2018000    
 C  -0.1992000      0.5504000      0.1864000    
 C   0.6411000     -0.5342000     -0.5583000    
 C   -3.681600     -0.8492000     -0.2335000    
 C   -2.723500       1.349400      0.3495000    
 C   -1.429900      -2.082000     -0.5293000    
 C   -4.061700      0.5883000      0.1862000    
 C   8.5100003E-02  -1.957600     -0.2877000    
 C   0.3589000       1.933000     -0.1568000    
 C   -2.155900      -1.291300       1.745000    
 C    2.135100     -0.3697000     -0.2911000    
 C    1.779600       2.071600      0.3824000    
 C    2.659400      0.8772000      0.1120000    
 C    3.036500      -1.423900     -0.5250000    
 C    4.042400       1.021500      0.3225000    
 C    4.409100      -1.264700     -0.3212000    
 C    4.912000     -4.3499999E-02  0.1078000    
 H   -1.712600      0.4580000      -1.301200    
 H  -8.9900002E-02  0.4168000       1.270300    
 H   0.5259000     -0.3567000      -1.639000    
 H   -3.768500     -0.9660000      -1.320800    
 H   -2.532700       1.559200       1.407500    
 H   -1.615200      -1.996300      -1.608100    
 H   -1.768500      -3.083800     -0.2388000    
 H   -4.628500      0.6048000       1.123600    
 H   0.3274000      -2.261600      0.7377000    
 H   0.5728000      -2.687200     -0.9445000    
 H  -0.2512000       2.729300      0.2815000    
 H   0.3532000       2.082500      -1.244100    
 H   -1.135800      -1.267500       2.137400    
 H   -2.738200     -0.5749000       2.332700    
 H   -2.551300      -2.289500       1.966700    
 H    1.736400       2.217400       1.469400    
 H    2.231400       2.971800     -5.1700000E-02
 H   -4.662300      -1.579100       1.300400    
 H   -2.909800       2.390000      -1.288200    
 H   -5.063800       2.072300     -0.5740000    
 H    2.691500      -2.390800     -0.8787000    
 H    4.441500       1.977600      0.6554000    
 H    5.073100      -2.104900     -0.5063000    
 H    6.697400     -0.7262000      0.1134000    


%chk=000027125-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027125

0 1
O -4.672041 -1.781142 0.205017
O -2.695612 2.717713 -0.328742
O -4.854618 1.404331 -0.755212
O 6.354812 0.090451 0.309569
C -2.217571 -0.970704 0.216077
C -1.643734 0.430196 -0.179936
C -0.158718 0.585318 0.184012
C 0.654783 -0.522756 -0.559826
C -3.698121 -0.773274 -0.227374
C -2.683732 1.439219 0.372983
C -1.433136 -2.053577 -0.557787
C -4.054863 0.670583 0.236359
C 0.092239 -1.949532 -0.287344
C 0.429591 1.968223 -0.170714
C -2.167728 -1.255822 1.743370
C 2.163130 -0.383257 -0.290911
C 1.856300 2.090994 0.396727
C 2.725062 0.863794 0.126129
C 3.046849 -1.471821 -0.502894
C 4.121390 0.979310 0.315445
C 4.440255 -1.359518 -0.314425
C 4.976595 -0.118841 0.099349
H -1.721250 0.503947 -1.289444
H -0.037045 0.439587 1.279930
H 0.493958 -0.325939 -1.646449
H -3.754670 -0.816802 -1.331097
H -2.483361 1.667563 1.437091
H -1.616960 -1.920623 -1.644462
H -1.795564 -3.066160 -0.292968
H -4.604869 0.640079 1.199822
H 0.324108 -2.243434 0.755493
H 0.603880 -2.686010 -0.935171
H -0.212905 2.777171 0.218686
H 0.442125 2.083459 -1.273461
H -1.136222 -1.235763 2.130032
H -2.746753 -0.521953 2.335326
H -2.567235 -2.266556 1.955603
H 1.795450 2.243463 1.495099
H 2.356369 2.992031 -0.007374
H -4.665495 -1.829974 1.195176
H -3.516444 2.721549 -0.896664
H -5.685591 0.906046 -0.949559
H 2.648845 -2.438312 -0.828099
H 4.561703 1.931704 0.630839
H 5.094357 -2.223730 -0.489989
H 6.864637 -0.736331 0.122371


