%chk=000226349.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226349

0 1
 O   -1.593900     -0.1195000     -0.7778000    
 O  -0.3584000       2.369500     -0.8011000    
 O    6.914700      -1.628000      0.1243000    
 O    6.741700      0.5780000      0.6798000    
 C  -0.2562000     -8.5000005E-03 -0.5453000    
 C   -2.274100      -1.201600     -0.1449000    
 C   -3.703100     -0.8101000      9.2399999E-02
 C   0.3644000       1.240600     -0.5583000    
 C    2.485300      0.1921000     -6.8899997E-02
 C    1.735100       1.340900     -0.3201000    
 C   0.4939000      -1.157300     -0.2939000    
 C    1.864800      -1.057100     -5.5900000E-02
 C   -4.057500     -0.1870000       1.283800    
 C   -4.660200      -1.074000     -0.8811000    
 C    3.914600      0.2967000      0.1790000    
 C   -5.386000      0.1767000       1.504400    
 C   -5.988500     -0.7101000     -0.6605000    
 C   -6.351500     -8.4700003E-02  0.5322000    
 C    4.804900     -0.7129000      5.6100000E-02
 C  -0.9262000       3.030900      0.3277000    
 C    6.236500     -0.4746000      0.3281000    
 H   -1.828300      -1.462600      0.8249000    
 H   -2.228600      -2.088100     -0.7898000    
 H    2.208500       2.320400     -0.3345000    
 H   5.7399999E-02  -2.151600     -0.2994000    
 H    2.405700      -1.976400      0.1481000    
 H   -3.313300      2.4800001E-02   2.046600    
 H   -4.388400      -1.558800      -1.814700    
 H    4.266500       1.282800      0.4751000    
 H   -5.668500      0.6646000       2.432800    
 H   -6.740200     -0.9131000      -1.417800    
 H   -7.385800      0.1991000      0.7038000    
 H    4.523900      -1.711300     -0.2595000    
 H  -0.1394000       3.369200       1.009400    
 H   -1.620300       2.368200      0.8542000    
 H   -1.479400       3.903900     -2.9100001E-02
 H    7.875600      -1.523900      0.2928000    


%chk=000226349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226349

0 1
O -1.582234 0.212555 0.170950
O -0.150402 2.449338 -0.845255
O 7.195208 -1.765710 0.118730
O 7.023541 0.408322 -0.700666
C -0.185429 0.139040 0.117029
C -2.326152 -1.010604 0.563046
C -3.803559 -0.723293 0.414190
C 0.497650 1.296625 -0.376854
C 2.663127 0.115563 -0.141350
C 1.898100 1.261402 -0.502003
C 0.568715 -1.001025 0.500461
C 1.968128 -1.015007 0.372464
C -4.696048 -0.997836 1.478132
C -4.313819 -0.207117 -0.804465
C 4.116744 0.161939 -0.308753
C -6.083765 -0.771715 1.326230
C -5.697371 0.028676 -0.953371
C -6.587021 -0.257510 0.110030
C 5.018819 -0.828747 -0.018207
C -1.150038 3.098426 0.032450
C 6.455409 -0.619258 -0.246708
H -2.076651 -1.280442 1.608076
H -2.005361 -1.836761 -0.105090
H 2.390196 2.156544 -0.897906
H 0.062129 -1.888077 0.891552
H 2.519500 -1.911877 0.671880
H -4.308878 -1.386329 2.428257
H -3.622185 0.022272 -1.622734
H 4.534281 1.095728 -0.713713
H -6.766238 -0.989440 2.155082
H -6.083234 0.431832 -1.896218
H -7.661342 -0.077772 -0.008283
H 4.730217 -1.802765 0.387340
H -0.690543 3.369431 1.002478
H -2.021249 2.444579 0.195703
H -1.443357 4.010576 -0.508768
H 8.158811 -1.584364 -0.050838


