%chk=000080962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080962

0 1
 O   -1.613300      0.1851000     -0.1610000    
 O    3.607900      -1.550300     -0.6754000    
 O    4.514300      7.4100003E-02  0.8568000    
 O   -3.360000      0.8373000      -1.508500    
 C   -3.804200     -0.4808000      0.5009000    
 C   -3.625900      0.1533000       1.886800    
 C   -5.280600     -0.3691000      8.6999997E-02
 C   -3.407300      -1.962700      0.5349000    
 C   -2.930600      0.2600000     -0.5168000    
 C  -0.6949000      0.8438000      -1.039000    
 C   0.6986000      0.6689000     -0.5111000    
 C    2.727000     -0.5495000     -0.4022000    
 C    1.451200     -0.4316000     -0.9144000    
 C    3.244600      0.3780000      0.4728000    
 C    1.220000       1.617500      0.3801000    
 C    2.515000       1.474500      0.8839000    
 C    4.738200      -1.148300      0.1251000    
 H   -3.853000       1.225300       1.861400    
 H   -4.285800     -0.3152000       2.625400    
 H   -2.597200      4.8500001E-02   2.249900    
 H   -5.602300      0.6779000      4.2100001E-02
 H   -5.933500     -0.8892000      0.7969000    
 H   -5.449500     -0.8056000     -0.9043000    
 H   -2.374200      -2.096000      0.8752000    
 H   -4.054400      -2.531600       1.211800    
 H   -3.480700      -2.412700     -0.4619000    
 H  -0.9448000       1.910100      -1.104100    
 H  -0.7749000      0.4165000      -2.046400    
 H    1.055900      -1.171700      -1.601400    
 H   0.6222000       2.471100      0.6896000    
 H    2.926100       2.202400       1.574200    
 H    5.603200      -1.009600     -0.5336000    
 H    4.964500      -1.948400      0.8393000    


%chk=000080962-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080962

0 1
O -1.641446 0.342853 -0.058075
O 3.387148 -1.743649 -0.427578
O 4.634775 -0.005015 0.666157
O -3.392922 0.935043 -1.468229
C -3.828892 -0.559347 0.487825
C -3.710122 0.000345 1.935054
C -5.301656 -0.525397 0.016147
C -3.280522 -2.016066 0.444971
C -2.983916 0.314111 -0.458897
C -0.719633 1.155525 -0.928086
C 0.693880 0.891263 -0.477765
C 2.593726 -0.577063 -0.288973
C 1.283247 -0.386796 -0.721006
C 3.328547 0.444219 0.354380
C 1.436665 1.907745 0.170783
C 2.778132 1.703433 0.597883
C 4.674666 -1.433485 0.248953
H -4.084533 1.038838 1.993740
H -4.317140 -0.620536 2.619372
H -2.662577 -0.013013 2.279246
H -5.701852 0.503325 0.031214
H -5.919038 -1.153742 0.683862
H -5.400229 -0.904242 -1.015824
H -2.226466 -2.051208 0.768261
H -3.879492 -2.653500 1.121137
H -3.350499 -2.439384 -0.573993
H -0.997363 2.218687 -0.821581
H -0.903806 0.854416 -1.975400
H 0.723973 -1.184620 -1.217380
H 0.966490 2.880088 0.353713
H 3.351155 2.490580 1.093599
H 5.500168 -1.573939 -0.468036
H 4.771130 -2.067468 1.148528


