%chk=000125922.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125922

0 1
 O   -5.200400      6.8899997E-02  3.4600001E-02
 O   -4.047200      -2.447900     -5.2900001E-02
 O   -3.584600       2.318500      2.3300000E-02
 O    6.842800     -7.6200001E-02  7.4600004E-02
 C   -1.088000     -0.3281000     -0.1127000    
 C   -3.844200     -6.1900001E-02 -1.4000000E-02
 C   -3.266900      -1.331200     -5.8499999E-02
 C   -3.033700       1.073400     -1.9400001E-02
 C   -1.879400      -1.465000     -0.1080000    
 C   -1.646100      0.9394000     -6.8999998E-02
 C   0.3779000     -0.4694000     -0.1649000    
 C    2.714000      0.3375000      0.1690000    
 C    1.267300      0.4833000      0.2023000    
 C    3.298400     -0.6459000     -0.6290000    
 C    3.517000       1.182100      0.9356000    
 C    5.489200      5.9700001E-02  0.1061000    
 C    4.686000     -0.7849000     -0.6604000    
 C    4.904700       1.043200      0.9041000    
 C   -5.820100      0.7846000      -1.031400    
 C   -4.374400      -3.003500       1.219300    
 C   -2.685700       3.425700      1.4400000E-02
 C    7.373500      -1.102200     -0.7630000    
 H   -1.438200      -2.458200     -0.1414000    
 H  -0.9962000       1.802900     -0.1075000    
 H   0.7173000      -1.444000     -0.5051000    
 H   0.9270000       1.436500      0.5969000    
 H    2.716000      -1.311000      -1.259600    
 H    3.080300       1.953700       1.565100    
 H    5.074400      -1.565700      -1.305400    
 H    5.525200       1.703800       1.503500    
 H   -5.973200       1.828300     -0.7431000    
 H   -6.801500      0.3364000      -1.212000    
 H   -5.242200      0.7260000      -1.960400    
 H   -3.467100      -3.317200       1.745300    
 H   -4.928900      -2.279900       1.825000    
 H   -5.006200      -3.881100       1.057500    
 H   -2.041600       3.432400      0.9005000    
 H   -3.295700       4.333900      6.1600000E-02
 H   -2.116400       3.476900     -0.9200000    
 H    7.141800     -0.9203000      -1.818000    
 H    7.054000      -2.096500     -0.4331000    
 H    8.463600      -1.067900     -0.6648000    


%chk=000125922-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125922

0 1
O -5.275706 -0.067934 0.102793
O -3.956897 -2.573971 -0.332057
O -3.745030 2.240581 0.417859
O 7.112032 0.125689 -0.256239
C -1.009759 -0.322620 -0.039656
C -3.870948 -0.121557 0.045149
C -3.237228 -1.383038 -0.120629
C -3.045850 1.036720 0.210273
C -1.829217 -1.473535 -0.163496
C -1.642096 0.939818 0.159389
C 0.449160 -0.489031 -0.108992
C 2.858290 0.325829 -0.089887
C 1.400319 0.495256 -0.019258
C 3.501275 -0.930888 -0.275771
C 3.697497 1.475430 0.032038
C 5.709677 0.117216 -0.211522
C 4.903808 -1.044690 -0.337172
C 5.096571 1.381560 -0.026370
C -5.941569 0.769361 -0.920460
C -4.955782 -2.943626 0.694585
C -2.953276 3.450075 0.652272
C 7.791713 -1.158229 -0.445544
H -1.386221 -2.464255 -0.309421
H -1.030145 1.836934 0.282559
H 0.779057 -1.527989 -0.250237
H 1.069481 1.535131 0.119640
H 2.900545 -1.841408 -0.376236
H 3.234385 2.459613 0.175971
H 5.356059 -2.030573 -0.482164
H 5.734486 2.265485 0.067980
H -5.663289 1.828580 -0.793165
H -7.019614 0.629990 -0.746583
H -5.673246 0.418341 -1.934806
H -4.454516 -3.118296 1.666668
H -5.721968 -2.158122 0.798531
H -5.403523 -3.881638 0.331863
H -2.313310 3.340711 1.548953
H -3.692168 4.247763 0.818892
H -2.325291 3.699763 -0.225177
H 7.512711 -1.623188 -1.411131
H 7.567229 -1.858600 0.382398
H 8.864850 -0.917557 -0.446739


