%chk=000006970.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006970

0 1
 O   0.3845000     -0.5641000     -0.3932000    
 O  -0.8589000     -0.1825000      -2.292500    
 O   -3.211400      0.9697000      -1.572000    
 C    2.744400     -0.1428000     -6.3000000E-03
 C    1.517000      0.1497000     -0.8866000    
 C    2.565000      0.4342000       1.406100    
 C    1.022100       2.229600      0.4955000    
 C    1.198900       1.647800     -0.9162000    
 C    2.248100       1.928200       1.366800    
 C    3.041400      -1.641600      7.0299998E-02
 C   0.7665000       3.734500      0.4287000    
 C    3.186100      -2.229500      -1.330500    
 C    4.300500      -1.895200      0.8944000    
 C  -0.7688000     -0.4049000      -1.095000    
 C   -1.946400     -0.5369000     -0.2004000    
 C   -3.106300      0.1559000     -0.4838000    
 C   -1.836300      -1.362100      0.9019000    
 C   -4.201300      1.8600000E-02  0.3693000    
 C   -2.931300      -1.499500       1.754900    
 C   -4.113800     -0.8092000       1.488600    
 H    3.606100      0.3644000     -0.4643000    
 H    1.713100     -0.1650000      -1.918200    
 H    3.475800      0.3186000       2.002000    
 H    1.763400     -9.4899997E-02   1.936600    
 H   0.1440000       1.764700      0.9621000    
 H   0.3043000       1.870300      -1.506600    
 H    2.027600       2.167800      -1.415900    
 H    2.076100       2.287400       2.388700    
 H    3.121200       2.471900      0.9832000    
 H    2.214700      -2.166600      0.5666000    
 H  -0.1298000       3.949900     -0.1626000    
 H   0.6130000       4.146900       1.431400    
 H    1.609800       4.262600     -2.9300001E-02
 H    3.897900      -1.658200      -1.936200    
 H    3.550400      -3.261900      -1.279500    
 H    2.229300      -2.270300      -1.859700    
 H    5.138600      -1.278400      0.5525000    
 H    4.608900      -2.943900      0.8142000    
 H    4.139300      -1.707100       1.959900    
 H  -0.9336000      -1.922500       1.126300    
 H   -5.128800      0.5502000      0.1743000    
 H   -2.864600      -2.146400       2.624800    
 H   -4.966500     -0.9169000       2.152500    
 H   -4.101200       1.362100      -1.590700    


%chk=000006970-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006970

0 1
O 0.236213 0.077918 -0.114102
O -0.848480 0.156883 -2.178573
O -3.434999 -0.782656 -2.160284
C 2.676920 -0.045463 0.000236
C 1.493019 0.582990 -0.770407
C 2.756323 0.544994 1.434777
C 1.567222 2.699539 0.698794
C 1.486818 2.122730 -0.734398
C 2.786703 2.091807 1.433615
C 2.649595 -1.607526 -0.018649
C 1.619943 4.241113 0.675679
C 2.504973 -2.176256 -1.453023
C 3.913579 -2.206412 0.648498
C -0.889328 -0.076377 -0.947256
C -2.068338 -0.539196 -0.155372
C -3.313600 -0.871311 -0.772655
C -1.974839 -0.651199 1.260557
C -4.412099 -1.294013 0.021093
C -3.063748 -1.069449 2.047329
C -4.290693 -1.391999 1.419789
H 3.589536 0.278213 -0.552150
H 1.466772 0.244404 -1.820687
H 3.657664 0.163740 1.948290
H 1.878926 0.192056 2.013892
H 0.651753 2.384745 1.242708
H 0.586134 2.492813 -1.259574
H 2.363745 2.476565 -1.317558
H 2.825764 2.469095 2.474847
H 3.715747 2.441128 0.932936
H 1.762701 -1.927929 0.566073
H 0.736462 4.666636 0.163683
H 1.651855 4.656763 1.700422
H 2.522611 4.595435 0.140172
H 3.318543 -1.809220 -2.109551
H 2.562329 -3.280456 -1.435226
H 1.541634 -1.905096 -1.918888
H 4.832263 -1.853830 0.139128
H 3.897157 -3.310178 0.582813
H 3.993251 -1.939972 1.716978
H -1.018829 -0.398493 1.725084
H -5.363255 -1.546374 -0.466573
H -2.961337 -1.143709 3.134340
H -5.149517 -1.718969 2.016059
H -4.348093 -1.048886 -2.440764


