%chk=000014864.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014864

0 1
 O    2.240800     -0.6552000      0.3850000    
 O    4.424100     -0.5848000      6.7299999E-02
 O    3.178200       1.286000     -0.4430000    
 C   -3.876700      0.5702000      9.8899998E-02
 C   -4.962400     -0.4893000     -9.6799999E-02
 C   -2.481400     -5.7100002E-02  0.1058000    
 C   -6.354100      0.1418000     -0.1369000    
 C   -1.394100       1.005000      0.2679000    
 C   -7.433700     -0.9042000     -0.3650000    
 C  -5.8899999E-02  0.3935000      0.3104000    
 C    1.033300     -0.1037000      0.3463000    
 C    5.615900      9.5899999E-02 -0.3396000    
 C    6.798800     -0.8321000     -0.1624000    
 C    3.270400      0.1340000     -3.7999999E-02
 H   -4.046700       1.101700       1.043100    
 H   -3.939800       1.312500     -0.7062000    
 H   -4.913200      -1.222400      0.7175000    
 H   -4.779900      -1.032600      -1.032000    
 H   -2.320300     -0.6109000     -0.8281000    
 H   -2.412800     -0.7884000      0.9216000    
 H   -6.552400      0.6657000      0.8054000    
 H   -6.402700      0.8872000     -0.9393000    
 H   -1.563800       1.572900       1.190100    
 H   -1.444500       1.718400     -0.5629000    
 H   -8.420500     -0.4315000     -0.3887000    
 H   -7.282600      -1.423000      -1.317000    
 H   -7.433200      -1.649600      0.4367000    
 H    5.528600      0.3874000      -1.392200    
 H    5.752900      0.9919000      0.2760000    
 H    7.728700     -0.3426000     -0.4649000    
 H    6.888500      -1.146900      0.8826000    
 H    6.667800      -1.741500     -0.7582000    


%chk=000014864-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014864

0 1
O 2.301511 -0.430433 0.352455
O 4.502099 -0.519116 0.058756
O 3.408021 1.488061 -0.508805
C -3.946468 0.582324 0.084184
C -5.028843 -0.499907 -0.128173
C -2.512907 0.007699 0.084261
C -6.467303 0.066726 -0.132357
C -1.439956 1.109784 0.310996
C -7.541498 -1.023017 -0.339203
C -0.061374 0.589647 0.318387
C 1.088645 0.158292 0.310126
C 5.825922 0.069309 -0.342869
C 6.861568 -1.028085 -0.138831
C 3.432448 0.321106 -0.088488
H -4.134773 1.104756 1.045728
H -4.036213 1.351679 -0.711339
H -4.941265 -1.267922 0.668495
H -4.840714 -1.025458 -1.087647
H -2.310470 -0.502216 -0.877562
H -2.415087 -0.759989 0.876353
H -6.653354 0.594911 0.825196
H -6.555589 0.831338 -0.931092
H -1.647553 1.627009 1.269626
H -1.532874 1.877485 -0.483525
H -8.560341 -0.593785 -0.339757
H -7.394291 -1.546061 -1.303043
H -7.494661 -1.782380 0.464107
H 5.749859 0.396334 -1.395346
H 6.010502 0.955073 0.291107
H 7.861721 -0.647656 -0.414958
H 6.890970 -1.351978 0.914984
H 6.636567 -1.905229 -0.768366


