%chk=000100968.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100968

0 1
 O   0.6071000      -1.951800      1.4700000E-02
 O   -4.137600       1.906600      0.7106000    
 O   -1.060200      -1.336100       1.490400    
 C  -0.6431000       1.276400     -5.9400000E-02
 C  -0.7736000     -0.1606000     -0.5953000    
 C   0.7272000       1.551500      0.5611000    
 C   -1.767700       1.622700      0.9183000    
 C    1.850400       1.243500     -0.4239000    
 C   -2.171900     -0.4601000      -1.082500    
 C   -3.127500       1.314500      0.3329000    
 C    3.217500       1.549900      0.1898000    
 C   -3.248400      0.2296000     -0.6725000    
 C  -0.4505000      -1.202700      0.4379000    
 C   -2.306000      -1.567900      -2.091100    
 C    4.350300       1.212200     -0.7793000    
 C    5.712200       1.484000     -0.1606000    
 C    1.023500      -2.988400      0.9091000    
 C    2.198400      -3.723200      0.2997000    
 H  -0.7538000       1.950300     -0.9232000    
 H  -0.1056000     -0.2712000      -1.458500    
 H   0.7838000       2.606600      0.8577000    
 H   0.8627000      0.9641000       1.477600    
 H   -1.670800       1.089100       1.868900    
 H   -1.734200       2.697300       1.135600    
 H    1.851500      0.1912000     -0.7179000    
 H    1.717600       1.836800      -1.336800    
 H    3.270500       2.610900      0.4628000    
 H    3.342500      0.9715000       1.113500    
 H   -4.244200      1.1300000E-02  -1.042800    
 H   -3.343900      -1.712100      -2.409800    
 H   -1.954800      -2.515600      -1.670600    
 H   -1.714000      -1.342400      -2.984100    
 H    4.245200       1.804500      -1.695700    
 H    4.292800      0.1559000      -1.067100    
 H    5.861700      0.8800000      0.7400000    
 H    6.507300       1.236900     -0.8710000    
 H    5.815700       2.539200      0.1119000    
 H   0.1940000      -3.685800       1.071200    
 H    1.319800      -2.546200       1.866800    
 H    2.544100      -4.523900      0.9594000    
 H    1.922500      -4.155800     -0.6677000    
 H    3.028900      -3.033900      0.1141000    


%chk=000100968-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100968

0 1
O 0.372362 -2.299356 -0.023877
O -4.150350 1.956249 0.660686
O -0.576784 -1.136584 1.754634
C -0.579431 1.272417 -0.090148
C -0.701473 -0.208441 -0.562600
C 0.801693 1.618789 0.520283
C -1.731287 1.651122 0.872844
C 2.009009 1.343778 -0.406109
C -2.115858 -0.537801 -1.064191
C -3.111571 1.313970 0.314718
C 3.342065 1.858576 0.182669
C -3.198549 0.187220 -0.642354
C -0.319404 -1.218091 0.532468
C -2.236713 -1.682406 -2.043143
C 4.562798 1.564223 -0.718632
C 5.889176 2.086341 -0.125437
C 0.775540 -3.384129 0.930559
C 1.496882 -4.447477 0.109873
H -0.701235 1.876871 -1.015320
H -0.000873 -0.389499 -1.398633
H 0.792055 2.696740 0.782977
H 0.930255 1.070964 1.475386
H -1.609060 1.102100 1.827044
H -1.710520 2.730177 1.109981
H 2.103190 0.255368 -0.599104
H 1.836205 1.823993 -1.392693
H 3.269871 2.952922 0.354564
H 3.504339 1.398773 1.180097
H -4.204762 -0.042913 -1.014624
H -3.289156 -1.920310 -2.269136
H -1.738296 -2.590315 -1.654007
H -1.724553 -1.434354 -2.994357
H 4.397421 2.020645 -1.716086
H 4.636247 0.470020 -0.886439
H 6.093094 1.622773 0.858350
H 6.745751 1.863827 -0.787964
H 5.852475 3.182150 0.022887
H -0.136705 -3.768152 1.421620
H 1.420189 -2.935204 1.707354
H 1.822247 -5.271556 0.770558
H 0.833934 -4.867482 -0.665861
H 2.389180 -4.027142 -0.384635


