%chk=000152309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152309

0 1
 O   -5.743800       1.223400       1.016000    
 O    6.013300       1.417700      0.2761000    
 O   0.9274000      -2.632500     -0.4915000    
 O   -1.614700      -2.966900      0.8314000    
 C  -0.3878000      0.4089000     -0.7910000    
 C   -1.839900      0.2661000     -0.3391000    
 C   0.5723000     -0.3154000      0.1911000    
 C    2.041300     -2.1100000E-02 -0.1065000    
 C   -2.013500      0.7795000       1.097100    
 C   -2.782000       1.001800      -1.302200    
 C    2.285200       1.492400     -0.1873000    
 C    2.948200     -0.6670000      0.9502000    
 C  -0.2083000     -3.2499999E-02  -2.260000    
 C   -3.467700      0.6972000       1.551300    
 C   -4.234100      0.9193000     -0.8411000    
 C    3.757300       1.812100     -0.4298000    
 C    4.418400     -0.3411000      0.7046000    
 C   -4.401300       1.427500      0.5895000    
 C    4.655600       1.165300      0.6211000    
 C   0.3569000      -1.820400      0.2227000    
 C  -0.6416000      -1.470200      -2.520700    
 C  -0.6413000      -2.344100       1.218100    
 H  -0.1834000       1.484500     -0.7577000    
 H   -2.157200     -0.7788000     -0.3372000    
 H   0.4202000      5.1899999E-02   1.210500    
 H    2.321900     -0.4618000      -1.072400    
 H   -1.441800      0.2031000       1.826300    
 H   -1.671900       1.819900       1.168700    
 H   -2.489000       2.055600      -1.389700    
 H   -2.750600      0.5690000      -2.306500    
 H    1.951700       1.982700      0.7358000    
 H    1.740500       1.947500      -1.019100    
 H    2.668200     -0.3124000       1.950700    
 H    2.844000      -1.756800      0.9625000    
 H   0.8336000      8.7700002E-02  -2.575800    
 H  -0.7601000      0.6414000      -2.924700    
 H   -3.773400     -0.3537000       1.639300    
 H   -3.568800       1.119700       2.558600    
 H   -4.877300       1.497800      -1.515300    
 H   -4.590600     -0.1169000     -0.9095000    
 H    4.053900       1.471300      -1.430700    
 H    3.911500       2.898100     -0.4301000    
 H    5.035200     -0.7691000       1.504100    
 H    4.758800     -0.8221000     -0.2217000    
 H   -4.200800       2.505200      0.6190000    
 H    4.467000       1.627900       1.597200    
 H   -1.363600      -1.896900      -1.827100    
 H   0.2249000      -2.129200      -2.614300    
 H   -1.119000      -1.508600      -3.508400    
 H   -5.821200       1.572800       1.920200    
 H  -0.4103000      -2.118800       2.270600    
 H    6.570400       1.002700      0.9565000    


%chk=000152309-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152309

0 1
O -5.991626 1.185695 0.876060
O 6.204237 1.404778 0.130207
O 0.882099 -2.692241 -0.369669
O -1.458207 -3.146516 1.394336
C -0.413739 0.384416 -0.733131
C -1.912454 0.219735 -0.310120
C 0.616867 -0.318029 0.254239
C 2.121718 -0.050591 -0.086660
C -2.176815 0.651111 1.160707
C -2.835829 1.055902 -1.243296
C 2.424465 1.452929 -0.317352
C 3.033322 -0.595495 1.049451
C -0.167164 0.060250 -2.243822
C -3.671901 0.535673 1.545115
C -4.329439 0.953906 -0.856545
C 3.926402 1.705930 -0.593406
C 4.531630 -0.349618 0.751695
C -4.555495 1.373309 0.600282
C 4.808269 1.150671 0.532232
C 0.357315 -1.818772 0.371126
C -0.732806 -1.269353 -2.799622
C -0.556679 -2.290477 1.522442
H -0.191234 1.466860 -0.610370
H -2.209694 -0.846094 -0.411538
H 0.426159 0.126838 1.254400
H 2.371522 -0.612879 -1.009111
H -1.592027 0.038883 1.873065
H -1.833476 1.700263 1.293273
H -2.511958 2.118477 -1.204368
H -2.720502 0.730221 -2.291930
H 2.106014 2.030020 0.577472
H 1.841771 1.844304 -1.170892
H 2.760544 -0.094566 2.003868
H 2.866990 -1.679789 1.190102
H 0.920214 0.089010 -2.444088
H -0.593996 0.895157 -2.833635
H -3.996781 -0.521833 1.481890
H -3.815637 0.861895 2.596011
H -4.946664 1.584846 -1.522172
H -4.684897 -0.088714 -0.973157
H 4.227360 1.211663 -1.538105
H 4.121925 2.787147 -0.714923
H 5.151104 -0.737773 1.586223
H 4.831133 -0.899274 -0.162552
H -4.286223 2.449256 0.719290
H 4.583944 1.696685 1.478704
H -1.822427 -1.358133 -2.638293
H -0.249600 -2.149366 -2.348364
H -0.558919 -1.317705 -3.890545
H -6.166842 1.399497 1.828009
H -0.319587 -1.827396 2.517587
H 6.810315 1.012990 0.809679


