%chk=000154656.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154656

0 1
 O    2.387200      -2.196100       1.812400    
 O    3.213100      -2.065000      -1.730100    
 O   -5.397600       1.072400       1.355600    
 O   -5.634400     -0.8129000      -1.701400    
 C    1.149700     -0.8640000      0.2320000    
 C    2.097400      -2.029300      0.4243000    
 C    1.655600      0.4323000      3.7700001E-02
 C    3.417300      -1.844100     -0.3364000    
 C   -1.187200     -5.5100001E-02  0.1219000    
 C    3.122000      0.6512000      8.7000001E-03
 C    3.986600     -0.4542000     -0.1680000    
 C   -2.606200     -0.2348000      0.1591000    
 C  -0.6707000       1.243100     -0.1019000    
 C  -0.2388000      -1.092000      0.2826000    
 C   -3.464400      0.8711000     -3.7799999E-02
 C   -4.970000      0.7236000      3.7000000E-02
 C   0.7206000       1.464900     -0.1398000    
 C   -5.468100     -0.6917000     -0.2896000    
 C   -1.545300       2.321300     -0.2870000    
 C   -2.923300       2.140700     -0.2536000    
 C   -3.230200      -1.549800      0.4074000    
 C   -4.532200      -1.764100      0.1768000    
 C    3.711100       1.919800      0.1643000    
 C    5.378600     -0.2728000     -0.2210000    
 C    5.098200       2.089700      0.1220000    
 C    5.931100      0.9954000     -7.5199999E-02
 H    1.609000      -2.947800      7.4900001E-02
 H    4.149800      -2.581200      1.6000001E-02
 H  -0.5665000      -2.115900      0.4467000    
 H   -5.429900       1.436900     -0.6593000    
 H    1.068300       2.480100     -0.3267000    
 H   -6.450400     -0.8514000      0.1708000    
 H   -1.159600       3.324900     -0.4575000    
 H   -3.573600       3.000900     -0.3918000    
 H   -2.624500      -2.374900      0.7601000    
 H   -4.941400      -2.758100      0.3348000    
 H    3.106200       2.806900      0.3330000    
 H    6.037900      -1.123700     -0.3734000    
 H    2.939200      -2.991400       1.903900    
 H    2.885100      -2.974000      -1.837800    
 H    5.524800       3.081200      0.2442000    
 H    7.008000       1.128700     -0.1119000    
 H   -6.370000       1.069500       1.358900    
 H   -5.984000      -1.702000      -1.884100    


%chk=000154656-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154656

0 1
O 2.391454 -2.077969 1.918686
O 3.088975 -2.043114 -1.806808
O -5.369670 1.088967 1.435379
O -5.778159 -0.919617 -1.705535
C 1.116447 -0.898938 0.253959
C 2.079939 -2.046059 0.470662
C 1.643521 0.427035 0.038747
C 3.372122 -1.873381 -0.362676
C -1.208600 -0.065200 0.116459
C 3.115250 0.628015 0.004631
C 3.973381 -0.495004 -0.185629
C -2.642664 -0.263887 0.153474
C -0.682735 1.265580 -0.112105
C -0.257673 -1.125018 0.281202
C -3.503140 0.841389 -0.040081
C -5.008405 0.673303 0.055073
C 0.731584 1.472243 -0.149563
C -5.510977 -0.762480 -0.246185
C -1.591633 2.355387 -0.309527
C -2.968984 2.141502 -0.274907
C -3.237260 -1.591463 0.390552
C -4.571116 -1.840026 0.234478
C 3.707858 1.908757 0.161693
C 5.372724 -0.323331 -0.228064
C 5.106503 2.076366 0.110859
C 5.949068 0.957993 -0.088147
H 1.594415 -3.006692 0.180130
H 4.107220 -2.647656 -0.040094
H -0.603650 -2.150629 0.445867
H -5.509415 1.338763 -0.680390
H 1.089629 2.486570 -0.358788
H -6.514083 -0.884348 0.201047
H -1.187968 3.358924 -0.485818
H -3.662941 2.978254 -0.412347
H -2.581299 -2.413815 0.693200
H -4.981930 -2.841997 0.398261
H 3.075326 2.782447 0.350713
H 6.013703 -1.199622 -0.382939
H 3.136217 -2.716901 2.074391
H 2.630422 -2.913853 -1.943554
H 5.539570 3.074641 0.238341
H 7.036489 1.083070 -0.124953
H -6.358176 1.167359 1.488772
H -4.912839 -1.097265 -2.157666


