%chk=000006501.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006501

0 1
 O   0.1468000      -2.286200     -0.6252000    
 O   -2.313700      0.1361000      0.2985000    
 O   -1.647500     -0.5578000      -1.801800    
 C   0.5445000      -1.518500      0.5106000    
 C  -0.8968000      -1.687600      0.1542000    
 C    1.257800     -0.2385000      0.2398000    
 C    1.107900      -2.343900       1.605400    
 C   -1.644200     -0.6605000     -0.5825000    
 C   0.8108000      0.9467000      0.8239000    
 C    2.372800     -0.2258000     -0.5982000    
 C    1.479000       2.144600      0.5701000    
 C    3.040900      0.9721000     -0.8519000    
 C    2.594100       2.157200     -0.2677000    
 C   -3.087900       1.187000     -0.2883000    
 C   -3.764500       1.975000      0.8131000    
 H   -1.498700      -2.355100      0.7611000    
 H    1.047700      -1.813900       2.562400    
 H   0.5725000      -3.293000       1.723800    
 H    2.159500      -2.587300       1.417300    
 H  -4.3299999E-02  0.9516000       1.495100    
 H    2.732400      -1.142500      -1.058300    
 H    1.133600       3.066600       1.028500    
 H    3.909600      0.9819000      -1.503800    
 H    3.115000       3.089700     -0.4643000    
 H   -2.429500       1.846700     -0.8645000    
 H   -3.844100      0.7559000     -0.9537000    
 H   -4.365800       2.789000      0.3990000    
 H   -4.412300       1.324700       1.410100    
 H   -3.020600       2.397100       1.496900    


%chk=000006501-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006501

0 1
O 0.195207 -2.245808 -0.393581
O -2.657464 0.075898 0.184015
O -1.177641 0.092765 -1.627624
C 0.623651 -1.329731 0.733463
C -0.840350 -1.418302 0.298263
C 1.497588 -0.168810 0.328571
C 0.987442 -2.068109 2.015428
C -1.524182 -0.356038 -0.514490
C 2.000536 0.720824 1.314695
C 1.846588 0.038311 -1.030066
C 2.833517 1.800404 0.947890
C 2.686128 1.113453 -1.392592
C 3.181649 1.999149 -0.408169
C -3.452403 1.161100 -0.473412
C -4.648086 1.440381 0.430404
H -1.516305 -1.974934 0.960106
H 0.844097 -1.426218 2.902951
H 0.354152 -2.963554 2.129937
H 2.043416 -2.387779 1.986759
H 1.742935 0.578065 2.370192
H 1.451060 -0.646301 -1.785038
H 3.211517 2.481929 1.718264
H 2.949839 1.260919 -2.445635
H 3.832113 2.833730 -0.693189
H -2.796678 2.041943 -0.596879
H -3.749722 0.809642 -1.477944
H -5.268960 2.241824 -0.009863
H -5.274695 0.539593 0.545530
H -4.318949 1.766957 1.431618


