%chk=000001213.chk
%nprocshared=4
%mem=8GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001213

0 1
 O   0.6698000      0.5206000      -1.865700    
 C  -0.4782000     -0.9636000     -0.2739000    
 C   9.7700000E-02  0.4752000     -0.5487000    
 C    1.213900      0.8592000      0.4823000    
 C   0.6664000      -2.000800     -0.1048000    
 C   -1.358200     -0.9500000       1.008700    
 C   -1.049600       1.514500     -0.5676000    
 C    2.310400     -0.2170000      0.5721000    
 C    1.739700      -1.588700      0.8943000    
 C   -2.456700      0.1128000      0.9882000    
 C   -1.904800       1.501500      0.6942000    
 C   -1.339200      -1.470200      -1.462000    
 C    1.888700       2.206500      0.1829000    
 H   0.7664000      0.9423000       1.480100    
 H    1.152700      -2.177800      -1.073400    
 H   0.2514000      -2.969400      0.2030000    
 H  -0.7410000     -0.7752000       1.896900    
 H   -1.821700      -1.934000       1.155800    
 H   -1.693900       1.336100      -1.438400    
 H  -0.6610000       2.524200     -0.7396000    
 H    3.032300      5.3900000E-02   1.352800    
 H    2.876900     -0.2663000     -0.3659000    
 H    2.547900      -2.329700      0.8834000    
 H    1.334900      -1.592600       1.912400    
 H   -2.970600      0.1231000       1.956500    
 H   -3.215700     -0.1469000      0.2415000    
 H   -2.736900       2.205700      0.5783000    
 H   -1.318600       1.855000       1.549800    
 H  -0.7465000      -1.557900      -2.379300    
 H   -1.750100      -2.463900      -1.247500    
 H   -2.184500     -0.8137000      -1.683200    
 H    2.691700       2.403200      0.9023000    
 H    2.329700       2.225900     -0.8189000    
 H    1.183100       3.037500      0.2656000    
 H    1.363300     -0.1555000      -1.928700    


%chk=000001213-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001213

0 1
O 0.720476 0.495940 -1.914479
C -0.487661 -0.986313 -0.269033
C 0.110569 0.454761 -0.554776
C 1.211577 0.842837 0.502774
C 0.663390 -2.029681 -0.107024
C -1.353456 -0.938179 1.032411
C -1.025598 1.499641 -0.628931
C 2.329048 -0.231634 0.574103
C 1.762362 -1.629048 0.901066
C -2.455387 0.149684 1.005509
C -1.876758 1.543650 0.660841
C -1.368462 -1.469051 -1.455067
C 1.814736 2.241851 0.240345
H 0.726732 0.858454 1.499986
H 1.132968 -2.204467 -1.099737
H 0.216182 -3.000540 0.186666
H -0.706958 -0.765963 1.914931
H -1.816508 -1.935517 1.177799
H -1.666122 1.245439 -1.493576
H -0.594345 2.491602 -0.850014
H 3.068067 0.071105 1.340994
H 2.890116 -0.263784 -0.386217
H 2.571330 -2.385225 0.891429
H 1.351641 -1.623811 1.930210
H -2.968297 0.181904 1.986626
H -3.228284 -0.117066 0.258205
H -2.699695 2.273416 0.534756
H -1.262744 1.910597 1.508098
H -0.813961 -1.393927 -2.406429
H -1.658138 -2.525724 -1.298188
H -2.295980 -0.883265 -1.567424
H 2.692591 2.409711 0.892131
H 2.138966 2.331707 -0.811947
H 1.093293 3.052796 0.443768
H 1.474011 -0.147900 -1.936307


