%chk=000057902.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057902

0 1
 O   -3.768800     -2.7600000E-02 -1.1500000E-02
 O   -3.337000       1.952700       1.079600    
 C    1.145800     -8.7800004E-02 -2.7799999E-02
 C   0.1897000      -1.094500      0.1055000    
 C   0.7593000       1.251600      1.7000001E-02
 C   0.5774000      -2.536300      5.9599999E-02
 C    1.763600       2.348300     -0.1238000    
 C    2.585700     -0.4447000     -0.2205000    
 C   -1.153200     -0.7618000      0.2837000    
 C  -0.5836000       1.584400      0.1954000    
 C   -1.539800      0.5777000      0.3286000    
 C   0.5395000      -3.101100      -1.366300    
 C    1.964100       2.765500      -1.586500    
 C    3.365000     -0.5843000       1.072600    
 C   0.9676000      -4.559300      -1.409900    
 C    2.962400       3.904500      -1.719000    
 C   -2.939700      0.9246000      0.5156000    
 C    4.827300     -0.9094000      0.9572000    
 C    2.772200     -0.4523000       2.269700    
 C   -5.176800      0.2018000      0.1092000    
 C   -5.920800     -0.9521000     -0.5284000    
 H    1.552400      -2.717300      0.5236000    
 H  -0.1201000      -3.112400      0.6839000    
 H    2.721100       2.097100      0.3444000    
 H    1.415000       3.221500      0.4457000    
 H    3.093100      0.2880000     -0.8562000    
 H    2.693400      -1.370200     -0.7958000    
 H   -1.886500      -1.557100      0.3961000    
 H  -0.8841000       2.629500      0.2248000    
 H  -0.4768000      -3.017000      -1.771100    
 H    1.186800      -2.520600      -2.033300    
 H    2.306500       1.918100      -2.190800    
 H    1.006300       3.084600      -2.016000    
 H    1.995100      -4.676000      -1.050800    
 H   0.3130000      -5.178700     -0.7884000    
 H   0.9207000      -4.938100      -2.435600    
 H    2.626300       4.787200      -1.165700    
 H    3.944200       3.610400      -1.334600    
 H    3.079300       4.186500      -2.770100    
 H    5.310000      -1.006200       1.935300    
 H    4.963000      -1.854800      0.4221000    
 H    5.346400     -0.1195000      0.4050000    
 H    1.724200     -0.2297000       2.421700    
 H    3.353700     -0.5689000       3.180100    
 H   -5.437400       1.137600     -0.3974000    
 H   -5.443400      0.2756000       1.169300    
 H   -5.654300      -1.897100     -4.3699998E-02
 H   -5.648800      -1.049200      -1.584700    
 H   -7.002400     -0.8093000     -0.4537000    


%chk=000057902-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057902

0 1
O -3.890096 -0.103951 0.079895
O -3.445042 2.183514 0.085588
C 1.171731 -0.081152 -0.097866
C 0.180371 -1.112559 -0.058329
C 0.767090 1.291238 -0.064027
C 0.549179 -2.591175 -0.095627
C 1.772664 2.435812 -0.107041
C 2.650469 -0.442214 -0.153601
C -1.188348 -0.763594 -0.008392
C -0.608571 1.607402 -0.014107
C -1.592999 0.591791 0.007009
C 0.646194 -3.155654 -1.542016
C 2.112216 2.889852 -1.555888
C 3.357697 -0.619806 1.196625
C 1.012755 -4.654592 -1.566006
C 3.122361 4.056175 -1.584224
C -3.024452 0.998028 0.060903
C 4.825046 -0.999212 1.089309
C 2.737730 -0.453463 2.394187
C -5.345855 0.219134 0.134155
C -6.092895 -1.110842 0.133226
H 1.503719 -2.773920 0.432704
H -0.221537 -3.171492 0.448158
H 2.706874 2.162251 0.418519
H 1.355228 3.305847 0.435929
H 3.205641 0.327686 -0.725389
H 2.790040 -1.377580 -0.730880
H -1.951915 -1.547018 0.024059
H -0.937212 2.652604 0.014802
H -0.322946 -2.995771 -2.054073
H 1.396028 -2.576554 -2.117503
H 2.513185 2.030519 -2.130093
H 1.175436 3.189010 -2.065411
H 1.995358 -4.833466 -1.089595
H 0.262105 -5.255257 -1.018407
H 1.063801 -5.039441 -2.600944
H 2.727510 4.935288 -1.040739
H 4.077624 3.768862 -1.105346
H 3.344251 4.371156 -2.620228
H 5.291235 -1.113624 2.082460
H 4.949910 -1.952282 0.537491
H 5.394661 -0.232114 0.527747
H 1.679626 -0.179884 2.462962
H 3.279952 -0.588367 3.337452
H -5.596956 0.847569 -0.739725
H -5.537651 0.812512 1.046762
H -5.811006 -1.722250 1.007625
H -5.871238 -1.686971 -0.781544
H -7.182368 -0.928148 0.173533


