%chk=000078191.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078191

0 1
 O   0.5497000       1.083000      0.7236000    
 O   -1.437600     -0.2124000      0.6869000    
 O   0.6579000      -1.292400      0.4804000    
 C  -8.8600002E-02 -9.3599997E-02  0.2088000    
 C   0.3281000       2.223500     -9.5700003E-02
 C   -2.290400     -0.8620000     -0.2466000    
 C    1.973900      -1.268000     -5.7200000E-02
 C   0.3053000       3.469500      0.7765000    
 C    1.413800       2.295200      -1.158500    
 C   -3.366300      -1.628500      0.5074000    
 C   -2.886400      0.1749000      -1.186400    
 C    2.896100      -2.079900      0.8394000    
 C    1.944400      -1.809200      -1.478500    
 H  -0.1223000     -7.3000002E-03 -0.8833000    
 H  -0.6530000       2.160600     -0.5818000    
 H   -1.724000      -1.598700     -0.8318000    
 H    2.374000     -0.2486000     -7.5599998E-02
 H   0.1256000       4.370400      0.1820000    
 H  -0.4801000       3.388500       1.535800    
 H    1.252100       3.586900       1.315000    
 H    1.300500       3.190400      -1.778200    
 H    1.387600       1.422600      -1.817800    
 H    2.408500       2.313900     -0.6993000    
 H   -4.037700      -2.154300     -0.1783000    
 H   -2.910200      -2.361600       1.181500    
 H   -3.961000     -0.9537000       1.132900    
 H   -3.605600     -0.2816000      -1.873600    
 H   -2.111800      0.6623000      -1.786000    
 H   -3.394100      0.9658000     -0.6233000    
 H    3.923100      -2.079800      0.4618000    
 H    2.896600      -1.670700       1.855500    
 H    2.551100      -3.116800      0.9182000    
 H    2.950500      -1.849000      -1.907400    
 H    1.322300      -1.188600      -2.130600    
 H    1.515300      -2.817100      -1.502100    


%chk=000078191-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078191

0 1
O 0.708028 1.151759 0.541696
O -1.348676 0.073966 0.347641
O 0.628136 -1.167135 0.332486
C 0.019238 0.062542 -0.099676
C 0.239065 2.520922 0.163300
C -2.217043 -1.018224 -0.190072
C 2.031813 -1.380924 -0.138409
C 0.759726 3.435239 1.276880
C 0.767010 2.917135 -1.229657
C -3.472438 -0.983492 0.687248
C -2.528176 -0.801451 -1.684419
C 2.627409 -2.399668 0.838533
C 2.043786 -1.873817 -1.598657
H 0.073414 0.161827 -1.211677
H -0.868147 2.508119 0.168612
H -1.675075 -1.972553 -0.045829
H 2.565238 -0.414296 -0.050117
H 0.441814 4.479351 1.101986
H 0.370983 3.102917 2.253837
H 1.863586 3.405025 1.314394
H 0.456674 3.950030 -1.474164
H 0.377066 2.255559 -2.024497
H 1.870946 2.872713 -1.246170
H -4.169868 -1.790223 0.396768
H -3.198396 -1.114690 1.747397
H -3.991170 -0.013819 0.580205
H -3.225209 -1.582146 -2.041367
H -1.619099 -0.857526 -2.310352
H -3.003141 0.184318 -1.838897
H 3.681369 -2.612882 0.582372
H 2.582397 -2.009108 1.868745
H 2.058308 -3.345953 0.801185
H 3.081295 -2.069733 -1.927603
H 1.609566 -1.128294 -2.289855
H 1.466870 -2.811788 -1.688165


