%chk=000170335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170335

0 1
 O   -1.872400      0.2710000     -0.1899000    
 O   0.6227000       1.259400      0.2698000    
 O    2.434500     -0.1790000     -0.1669000    
 C   -1.300800      -1.035800     -4.5600001E-02
 C   0.1841000     -0.9902000     -0.4795000    
 C   -1.513400      -1.439700       1.427400    
 C    1.106500     -8.7399997E-02  0.3611000    
 C   -2.080600      -1.964600     -0.9872000    
 C   -2.954000      -1.399100       1.916400    
 C   -1.764000      0.7296000      -1.525900    
 C    1.408500       2.180300       1.015100    
 C    2.942200      -1.505900     -0.1272000    
 C   -2.380100       2.108800      -1.625400    
 C   0.8234000       3.567700      0.8584000    
 C    4.343300      -1.515100     -0.7006000    
 H   0.5069000      -2.031500     -0.3734000    
 H   0.3219000     -0.7743000      -1.544400    
 H  -0.9572000     -0.7518000       2.075000    
 H   -1.102300      -2.441500       1.600600    
 H    1.119100     -0.3954000       1.412700    
 H   -3.157300      -1.761600     -0.9685000    
 H   -1.928100      -3.012400     -0.7022000    
 H   -1.749700      -1.891100      -2.029300    
 H   -2.994700      -1.656600       2.980000    
 H   -3.579100      -2.118400       1.379300    
 H   -3.391700     -0.4032000       1.798500    
 H   -2.314100      0.1000000      -2.229900    
 H  -0.7334000      0.8408000      -1.865900    
 H    1.406300       1.893800       2.072500    
 H    2.440600       2.181500      0.6489000    
 H    2.952300      -1.875600      0.9036000    
 H    2.370400      -2.187300     -0.7594000    
 H   -1.871300       2.808500     -0.9541000    
 H   -3.431700       2.084400      -1.320700    
 H   -2.318900       2.494800      -2.647100    
 H    1.404700       4.303700       1.420800    
 H   0.8056000       3.861500     -0.1963000    
 H  -0.2128000       3.590600       1.212000    
 H    4.766500      -2.523600     -0.6871000    
 H    4.342000      -1.145900      -1.731700    
 H    4.997900     -0.8510000     -0.1264000    


%chk=000170335-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170335

0 1
O -1.905914 0.114892 0.157213
O 0.973982 1.370968 -0.800795
O 2.392044 -0.397800 -0.175844
C -1.323788 -1.130734 -0.413129
C 0.079749 -0.845418 -1.032668
C -1.191043 -2.065721 0.822084
C 0.985458 0.068515 -0.186709
C -2.248967 -1.747895 -1.487986
C -2.520516 -2.392776 1.532808
C -2.297390 1.167413 -0.799510
C 1.663804 2.410026 -0.005467
C 2.668180 -1.388616 0.874233
C -2.656726 2.398253 0.034688
C 1.476050 3.739635 -0.733944
C 4.162165 -1.709156 0.821613
H 0.594944 -1.810700 -1.195520
H -0.021748 -0.368959 -2.025102
H -0.511740 -1.578258 1.548359
H -0.694437 -3.001406 0.494105
H 0.637248 0.144645 0.871373
H -3.278817 -1.854472 -1.106474
H -1.881688 -2.749438 -1.778833
H -2.280184 -1.125433 -2.400071
H -2.333835 -2.959180 2.463798
H -3.188923 -3.005093 0.900451
H -3.048047 -1.459180 1.791178
H -3.172349 0.832074 -1.395671
H -1.457006 1.396593 -1.483463
H 1.217632 2.441380 1.013377
H 2.733062 2.140989 0.085881
H 2.383306 -0.974811 1.868281
H 2.065135 -2.308856 0.706556
H -1.774927 2.747957 0.599708
H -3.457222 2.157474 0.756283
H -3.006687 3.220080 -0.617254
H 1.981394 4.554021 -0.183020
H 1.905710 3.685655 -1.749117
H 0.404243 3.989973 -0.823860
H 4.425743 -2.455208 1.593657
H 4.433980 -2.115630 -0.167800
H 4.759923 -0.797403 0.994090


