%chk=000004111.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004111

0 1
 O   -2.278800      -2.020600      0.5069000    
 O    3.804700      -3.088500     -0.3026000    
 O    5.231600      -1.307200     -0.3170000    
 C   -2.266800      0.9034000      2.5400000E-02
 C   -2.769900     -0.1675000     -0.9541000    
 C   -1.662800       2.096100     -0.7260000    
 C   -3.320900      -1.441300     -0.2813000    
 C   -1.157800       3.224400      0.2000000    
 C  -0.1040000       2.713900       1.205800    
 C   -4.515000      -1.152000      0.6311000    
 C   -3.718600      -2.458600      -1.356000    
 C  -0.5995000       4.363600     -0.6648000    
 C    1.122800       2.146400      0.5425000    
 C   -2.711400      -3.219200       1.129600    
 C    1.545100      0.8841000      0.7219000    
 C    2.723800      0.2594000      0.1190000    
 C    3.548000       1.091600     -0.8305000    
 C    2.987200      -1.027600      0.4210000    
 C    4.142400      -1.800500     -7.0799999E-02
 H   -3.092500       1.256400      0.6532000    
 H   -1.523600      0.4494000      0.6860000    
 H   -3.538400      0.2719000      -1.602800    
 H   -1.928500     -0.4511000      -1.600800    
 H   -2.428000       2.511400      -1.395200    
 H  -0.8511000       1.743700      -1.375000    
 H   -2.007500       3.617000      0.7733000    
 H  -0.5533000       1.993100       1.898000    
 H   0.2183000       3.555400       1.833000    
 H   -4.200000     -0.6940000       1.575300    
 H   -5.090900      -2.049500      0.8818000    
 H   -5.218200     -0.4699000      0.1392000    
 H   -4.337600      -1.984200      -2.126600    
 H   -2.835300      -2.884100      -1.846100    
 H   -4.311700      -3.292200     -0.9655000    
 H  -0.1762000       5.156400     -3.9099999E-02
 H   -1.400500       4.809400      -1.265000    
 H   0.1745000       4.021000      -1.358700    
 H    1.693900       2.831700     -7.6200001E-02
 H   -1.863500      -3.580100       1.722800    
 H   -3.525100      -3.073700       1.843400    
 H   -2.932600      -4.021000      0.4217000    
 H   0.9527000      0.2442000       1.374900    
 H    4.091300       1.869700     -0.2837000    
 H    4.275400      0.5165000      -1.406200    
 H    2.908400       1.571800      -1.580200    
 H    2.319500      -1.586800       1.073800    
 H    4.554400      -3.605500     -0.6673000    


%chk=000004111-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004111

0 1
O -1.702063 -1.606775 0.624515
O 2.529470 -3.522464 -0.698909
O 4.237904 -1.997434 -1.079094
C -2.494692 1.128176 -0.115011
C -2.606202 -0.124664 -1.015851
C -1.726645 2.284899 -0.798398
C -2.905222 -1.446382 -0.259824
C -1.243567 3.408679 0.158397
C -0.264943 2.874145 1.269375
C -4.196909 -1.350790 0.584453
C -2.978418 -2.618897 -1.264496
C -0.602960 4.565338 -0.645507
C 0.966346 2.174995 0.734309
C -1.692949 -2.767321 1.515932
C 1.059833 0.817088 0.579003
C 2.210336 0.090802 0.022197
C 3.468015 0.855292 -0.339917
C 2.060920 -1.274982 -0.146517
C 3.059800 -2.207319 -0.676263
H -3.500135 1.480213 0.192060
H -1.969936 0.823985 0.807324
H -3.381708 0.020076 -1.794213
H -1.642500 -0.270186 -1.542933
H -2.360707 2.740805 -1.587120
H -0.838393 1.869648 -1.315834
H -2.126455 3.812548 0.699872
H -0.820807 2.183919 1.930293
H 0.038061 3.741054 1.889961
H -4.087438 -0.599730 1.385507
H -4.457933 -2.319644 1.047308
H -5.044760 -1.049519 -0.057659
H -3.781129 -2.440769 -2.003510
H -2.021321 -2.715409 -1.807174
H -3.195971 -3.580270 -0.764891
H -0.256068 5.378644 0.019525
H -1.327631 4.997871 -1.360308
H 0.266888 4.207912 -1.228324
H 1.807110 2.813039 0.425292
H -0.730634 -2.717778 2.051580
H -2.517239 -2.732604 2.256582
H -1.740905 -3.725838 0.961764
H 0.201569 0.191818 0.867076
H 3.858531 1.393064 0.544595
H 4.248235 0.184871 -0.726092
H 3.243593 1.620027 -1.108092
H 1.102641 -1.735932 0.120249
H 3.230985 -4.127403 -1.063131


