%chk=000158504.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158504

0 1
 O    0.000000      3.0000001E-04 -0.6245000    
 O   -4.632600       1.848700     -0.7498000    
 O    4.630900      -1.852100     -0.7440000    
 O   -6.293400     -0.3767000     -0.6243000    
 O    6.293500      0.3724000     -0.6256000    
 C  -0.1982000     -0.7319000       1.638000    
 C   0.1988000      0.7396000       1.635600    
 C  -0.7172000     -0.9393000      0.2067000    
 C   0.7179000      0.9422000      0.2037000    
 C   -1.135800      -1.136300       2.767000    
 C    1.136500       1.147500       2.763300    
 C   -2.207300     -0.7854000     -1.6600000E-02
 C    2.208000      0.7864000     -1.9099999E-02
 C   -2.745700      0.4729000     -0.2837000    
 C    2.745100     -0.4733000     -0.2822000    
 C   -3.040200      -1.902200      4.6200000E-02
 C    3.041500       1.902700      4.0100001E-02
 C   -4.118100      0.6146000     -0.4884000    
 C    4.117400     -0.6168000     -0.4865000    
 C   -4.412600      -1.760600     -0.1585000    
 C    4.413800       1.759300     -0.1642000    
 C   -4.951500     -0.5021000     -0.4258000    
 C    4.951700      0.4995000     -0.4275000    
 C   -5.044100       2.629900      0.3702000    
 C    5.041800      -2.630000      0.3786000    
 C   -6.765800     -0.5108000      -1.963400    
 C    6.766000      0.5018000      -1.965100    
 H   0.7169000      -1.330700       1.747400    
 H  -0.7163000       1.338700       1.743100    
 H  -0.4260000      -1.937400     -0.1446000    
 H   0.4274000       1.939300     -0.1508000    
 H  -0.6400000      -1.028800       3.737400    
 H   -2.039200     -0.5184000       2.791200    
 H   -1.434900      -2.184600       2.667000    
 H    2.039700      0.5296000       2.789600    
 H    1.435800       2.195400       2.659800    
 H   0.6407000       1.043300       3.734000    
 H   -2.117500       1.357500     -0.3349000    
 H    2.116200      -1.357500     -0.3306000    
 H   -2.632700      -2.887700      0.2551000    
 H    2.634800       2.889100      0.2459000    
 H   -5.056100      -2.634700     -0.1071000    
 H    5.058000       2.633000     -0.1157000    
 H   -4.194000       2.832400       1.029400    
 H   -5.837200       2.119400      0.9257000    
 H   -5.434000       3.581700     -6.0000003E-04
 H    4.191300      -2.830000       1.038200    
 H    5.835100      -2.118200      0.9325000    
 H    5.431000      -3.583300      1.0900000E-02
 H   -6.322800      0.2557000      -2.607100    
 H   -7.851200     -0.3785000      -1.958600    
 H   -6.536300      -1.507600      -2.352900    
 H    6.537700       1.497800      -2.357600    
 H    6.321900     -0.2661000      -2.606400    
 H    7.851200      0.3681000      -1.960000    


%chk=000158504-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158504

0 1
O 0.000118 -0.002973 -0.728561
O -4.722162 1.876819 -0.721219
O 4.723859 -1.878999 -0.712795
O -6.461339 -0.470230 -0.486890
O 6.460998 0.470943 -0.489837
C -0.167552 -0.757478 1.565056
C 0.167105 0.760587 1.562245
C -0.726286 -0.985163 0.119898
C 0.725655 0.983109 0.116176
C -1.081486 -1.206218 2.717238
C 1.081173 1.213547 2.712669
C -2.233911 -0.821277 -0.044596
C 2.233369 0.819851 -0.047813
C -2.812827 0.441552 -0.310697
C 2.813387 -0.443599 -0.308462
C -3.085535 -1.947649 0.083285
C 3.083986 1.947535 0.075095
C -4.209218 0.586823 -0.437804
C 4.209894 -0.588169 -0.435123
C -4.482376 -1.816084 -0.066237
C 4.480914 1.816604 -0.074127
C -5.054821 -0.556475 -0.342559
C 5.054451 0.556349 -0.345139
C -5.640331 2.413937 0.309455
C 5.643009 -2.410679 0.319852
C -6.911852 -0.043772 -1.833312
C 6.911218 0.039216 -1.834700
H 0.791068 -1.312412 1.634804
H -0.791566 1.315645 1.630095
H -0.439201 -1.992019 -0.241243
H 0.437758 1.988391 -0.248717
H -0.583260 -1.048187 3.690996
H -2.031361 -0.642386 2.719344
H -1.331456 -2.280476 2.642556
H 2.031031 0.649695 2.716717
H 1.331173 2.287510 2.634010
H 0.583059 1.059109 3.687067
H -2.182452 1.323756 -0.455159
H 2.183774 -1.326979 -0.448977
H -2.654080 -2.937077 0.277780
H 2.651663 2.937412 0.265307
H -5.149353 -2.681361 0.005206
H 5.147100 2.682810 -0.006668
H -5.095510 2.565869 1.260930
H -6.494892 1.732959 0.473210
H -5.986066 3.382817 -0.082191
H 5.098735 -2.558886 1.272223
H 6.497011 -1.728203 0.480242
H 5.989439 -3.380975 -0.067649
H -6.482586 0.938493 -2.101196
H -8.009126 0.016343 -1.770164
H -6.617957 -0.798413 -2.587309
H 6.615969 0.790265 -2.591741
H 6.482948 -0.944691 -2.098120
H 8.008602 -0.019314 -1.771952


