%chk=000058512.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058512

0 1
 O   0.2939000       1.915800       1.368800    
 O    5.901800      0.3943000     -0.2768000    
 O   -6.035500     -0.3832000      0.1699000    
 C   0.4002000     -0.7324000      0.2640000    
 C  -0.4742000      0.4007000     -0.3677000    
 C   5.8699999E-02  -2.118900     -0.3418000    
 C    1.890400     -0.4275000      0.1174000    
 C   -1.973400      0.1891000     -0.2226000    
 C  -0.1113000       1.774300      0.2148000    
 C   0.8150000      -3.269000      0.3154000    
 C    2.649000     -0.2783000       1.256400    
 C    2.419600     -0.3129000      -1.148500    
 C   -2.747100      9.2299998E-02  -1.361200    
 C   -2.515600      0.1004000       1.043600    
 C  -0.2287000       2.955900     -0.7143000    
 C    4.009200      3.9999999E-04   1.122500    
 C    3.779800     -3.4400001E-02  -1.282400    
 C   -4.122000     -0.1013000      -1.228200    
 C   -3.890600     -9.3400002E-02   1.176600    
 C    4.574700      0.1222000     -0.1468000    
 C   -4.693800     -0.1944000      4.0700000E-02
 H   0.1686000     -0.7897000       1.337000    
 H  -0.2318000      0.4527000      -1.438000    
 H   0.2502000      -2.134900      -1.421400    
 H   -1.010700      -2.323200     -0.2155000    
 H    1.890100      -3.212400      0.1215000    
 H   0.4591000      -4.225000     -8.2300000E-02
 H   0.6562000      -3.274600       1.398400    
 H    2.219700     -0.3721000       2.248900    
 H    1.818700     -0.4344000      -2.043600    
 H   -2.313100      0.1628000      -2.354000    
 H   -1.906100      0.1794000       1.938300    
 H   1.3300000E-02   3.874400     -0.1724000    
 H   -1.251300       3.032800      -1.091100    
 H   0.4724000       2.839500      -1.544300    
 H    4.617500      0.1200000       2.015100    
 H    4.214800      5.8800001E-02  -2.273800    
 H   -4.736800     -0.1782000      -2.121100    
 H   -4.330300     -0.1643000       2.167800    
 H    6.296200      0.4705000      0.6091000    
 H   -6.433900     -0.4299000     -0.7162000    


%chk=000058512-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058512

0 1
O 0.021354 1.813145 1.653783
O 6.018909 0.395435 -0.500200
O -6.152211 -0.501907 0.101537
C 0.395492 -0.731051 0.280464
C -0.464119 0.442023 -0.317494
C -0.021164 -2.105119 -0.312183
C 1.887150 -0.438185 0.091174
C -1.977128 0.207021 -0.225740
C -0.139892 1.772528 0.404315
C 0.712762 -3.293386 0.345123
C 2.711573 -0.120873 1.198063
C 2.487990 -0.461967 -1.197370
C -2.756686 0.044184 -1.396609
C -2.631215 0.136769 1.035103
C -0.053466 3.016917 -0.461559
C 4.086554 0.159350 1.037445
C 3.857023 -0.183575 -1.378847
C -4.147361 -0.193570 -1.324181
C -4.015297 -0.100358 1.124139
C 4.658116 0.127348 -0.256131
C -4.774616 -0.267536 -0.057875
H 0.188573 -0.748151 1.368723
H -0.200419 0.557966 -1.386976
H 0.164394 -2.112630 -1.406144
H -1.112267 -2.230927 -0.182282
H 1.804862 -3.228968 0.192513
H 0.364647 -4.254210 -0.076443
H 0.526126 -3.315910 1.435668
H 2.267132 -0.075039 2.198408
H 1.883731 -0.714015 -2.077899
H -2.273129 0.093649 -2.379861
H -2.049389 0.285260 1.951834
H -0.000533 3.922985 0.161764
H -0.920884 3.077050 -1.144902
H 0.855149 2.957227 -1.092828
H 4.703286 0.405323 1.912109
H 4.320817 -0.205687 -2.369685
H -4.733053 -0.321346 -2.244060
H -4.524587 -0.153686 2.090903
H 6.492119 0.597674 0.344710
H -6.597445 -0.601856 -0.776309


