%chk=000102030.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102030

0 1
 O   -4.585300       1.578300      -1.293600    
 O   -4.781300      -1.255400     -0.6019000    
 O    6.072900      0.3021000     -0.4017000    
 C   0.3726000     -0.4861000     -0.2746000    
 C  -0.4456000      0.6413000      0.4239000    
 C   -1.898000      0.5790000     -5.7200000E-02
 C   -2.553600     -0.7805000      0.2517000    
 C    1.875700     -0.4972000      0.2156000    
 C  -0.3281000      -1.873000     -0.2092000    
 C   -1.824000      -1.839400     -0.5685000    
 C   -2.902400       1.611900      0.4526000    
 C   0.1758000       2.011500      0.1178000    
 C    2.442900      0.9285000      0.2652000    
 C    2.710600      -1.344500     -0.7904000    
 C   -3.967500     -0.4423000     -0.1839000    
 C   -4.248000       1.047400     -3.1300001E-02
 C   -2.628900      -1.168100       1.739200    
 C    1.668300       2.025800      0.2059000    
 C    2.002400      -1.110500       1.630900    
 C    3.943300       1.070200      0.3797000    
 C    4.223500      -1.227500     -0.6093000    
 C    4.674700      0.2287000     -0.6611000    
 H   0.3888000     -0.2229000      -1.345100    
 H  -0.4179000      0.4964000       1.509900    
 H   -1.865200      0.7071000      -1.152900    
 H  -0.2313000      -2.302400      0.7922000    
 H   0.1691000      -2.571000     -0.8919000    
 H   -1.935700      -1.635800      -1.641400    
 H   -2.265400      -2.829800     -0.4031000    
 H   -2.703400       2.608400      4.5600001E-02
 H   -2.874600       1.673600       1.545900    
 H  -0.2248000       2.750800      0.8218000    
 H  -0.1050000       2.347400     -0.8881000    
 H    2.470900      -1.036400      -1.817200    
 H    2.438100      -2.404000     -0.7152000    
 H   -5.051400       1.228600      0.6866000    
 H   -1.644700      -1.239000       2.209900    
 H   -3.221600     -0.4584000       2.326600    
 H   -3.117000      -2.143800       1.851700    
 H    2.130500       3.009900      0.2246000    
 H    3.020100      -1.034500       2.028200    
 H    1.345300     -0.6118000       2.350700    
 H    1.755800      -2.177100       1.633500    
 H    4.260100       2.116000      0.2734000    
 H    4.264600      0.7808000       1.388300    
 H    4.537500      -1.687900      0.3356000    
 H    4.734600      -1.798900      -1.394100    
 H    4.498200      0.6413000      -1.661900    
 H   -3.815400       1.504100      -1.882000    
 H    6.524300     -0.2352000      -1.074800    


%chk=000102030-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102030

0 1
O -4.811459 1.732540 -1.116017
O -4.754700 -1.152455 -0.948906
O 6.200126 0.285093 -0.282706
C 0.414425 -0.462060 -0.288474
C -0.404580 0.678870 0.400825
C -1.865890 0.620081 -0.079707
C -2.542451 -0.765603 0.173152
C 1.909109 -0.503227 0.215762
C -0.287285 -1.851857 -0.206860
C -1.783185 -1.842291 -0.624371
C -2.894668 1.663979 0.440890
C 0.224865 2.052170 0.069931
C 2.501954 0.921922 0.249252
C 2.750224 -1.357275 -0.797048
C -3.961087 -0.435123 -0.291644
C -4.267311 1.052903 0.067142
C -2.653275 -1.140880 1.685680
C 1.734282 2.042237 0.165524
C 2.018171 -1.127991 1.642515
C 4.015571 1.034937 0.397781
C 4.276027 -1.290575 -0.559888
C 4.768905 0.166580 -0.623830
H 0.459944 -0.184043 -1.367199
H -0.370041 0.539922 1.501595
H -1.835493 0.742135 -1.187578
H -0.210338 -2.249238 0.822209
H 0.249606 -2.571636 -0.853121
H -1.875675 -1.621917 -1.706542
H -2.227086 -2.843146 -0.464543
H -2.786010 2.650271 -0.039054
H -2.808852 1.805486 1.534023
H -0.184702 2.829583 0.746311
H -0.080098 2.361749 -0.955066
H 2.531911 -0.994981 -1.823521
H 2.422396 -2.413000 -0.752716
H -5.004066 1.095368 0.897712
H -1.656507 -1.274622 2.137071
H -3.182993 -0.369937 2.273038
H -3.207315 -2.090868 1.793067
H 2.232837 3.023078 0.170339
H 3.028450 -0.993854 2.065232
H 1.307802 -0.648698 2.339792
H 1.811431 -2.213710 1.625983
H 4.334671 2.087303 0.294004
H 4.344094 0.701077 1.403218
H 4.543108 -1.709561 0.429343
H 4.796351 -1.905778 -1.322813
H 4.591114 0.562158 -1.649849
H -5.472480 1.117425 -1.534972
H 6.724676 -0.276843 -0.908365


