%chk=000170615.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170615

0 1
 O    1.923500      -1.660400       1.858000    
 O   -3.146300     -0.4570000      0.3705000    
 O   -1.967800       1.373100     -0.3946000    
 C   0.2230000     -0.4026000      -1.006400    
 C   0.8262000     -8.8900000E-02  0.3758000    
 C    1.135200      -1.490500      -1.583700    
 C    1.503500      -2.380400     -0.4033000    
 C    1.474300      -1.408000      0.7465000    
 C    1.882100       1.006100      0.3245000    
 C   -1.224300     -0.8876000     -0.8917000    
 C    1.267400       2.365100     -8.8000000E-03
 C   -2.127800      0.1644000     -0.2951000    
 C    2.325900       3.453400     -8.8399999E-02
 C   -4.094700      0.4133000      0.9965000    
 H   0.2317000      0.4590000      -1.680200    
 H   6.5499999E-02  0.1466000       1.126900    
 H    2.043600      -1.031000      -1.993200    
 H   0.6649000      -2.060200      -2.391300    
 H    2.496200      -2.819900     -0.5232000    
 H   0.7549000      -3.159200     -0.2342000    
 H    2.660400      0.7600000     -0.4089000    
 H    2.391200       1.069300       1.295000    
 H   -1.273600      -1.787500     -0.2670000    
 H   -1.621500      -1.144700      -1.880200    
 H   0.5329000       2.635700      0.7590000    
 H   0.7392000       2.345300     -0.9659000    
 H    2.860700       3.550700      0.8618000    
 H    3.056400       3.233400     -0.8735000    
 H    1.862100       4.418200     -0.3167000    
 H   -4.848900     -0.2049000       1.490800    
 H   -4.588700       1.037500      0.2459000    
 H   -3.599600       1.033000       1.750300    


%chk=000170615-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170615

0 1
O 2.239625 -1.653780 1.824342
O -3.081855 -0.306296 0.509692
O -2.147861 1.282743 -0.913006
C 0.229727 -0.527465 -1.035282
C 0.907909 -0.186838 0.325518
C 1.135987 -1.645219 -1.646574
C 1.622758 -2.477436 -0.437007
C 1.662080 -1.473418 0.725078
C 1.897460 1.016604 0.257926
C -1.232134 -1.015812 -0.858515
C 1.178728 2.384385 0.206922
C -2.163357 0.116298 -0.455073
C 2.169628 3.559822 0.066391
C -4.069700 0.711934 0.949009
H 0.204125 0.360039 -1.692434
H 0.167692 0.041316 1.119153
H 2.003219 -1.182560 -2.153619
H 0.601613 -2.251359 -2.399226
H 2.605089 -2.962014 -0.569121
H 0.904267 -3.280248 -0.174749
H 2.554109 0.908437 -0.630550
H 2.555448 0.978611 1.148305
H -1.314186 -1.830928 -0.118541
H -1.602413 -1.411601 -1.825819
H 0.583358 2.508934 1.134287
H 0.451417 2.402823 -0.627773
H 2.893570 3.572627 0.902981
H 2.746380 3.484296 -0.874971
H 1.641279 4.530650 0.060344
H -4.684057 0.199206 1.701860
H -4.681076 1.044076 0.093228
H -3.551227 1.583471 1.382424


