%chk=000176150.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176150

0 1
 O    1.251200       1.465600      -2.160600    
 O   -3.847500     -0.8559000      0.7736000    
 O   -3.834200       1.364300      0.2250000    
 C   0.4931000      0.1966000     -0.2177000    
 C    1.346500     -0.1693000       1.034500    
 C  -1.6000000E-03  -1.173400     -0.7921000    
 C  -0.7890000       1.057000      6.0000001E-03
 C   0.9837000      -1.613100       1.377100    
 C   0.7216000      -2.258600      2.1700000E-02
 C    2.820300     -2.8999999E-02  0.5922000    
 C    1.497600      0.9736000      -1.065200    
 C    2.823900       1.141400     -0.3799000    
 C   -1.471800      -1.159200     -0.4490000    
 C   -1.878300      3.4800000E-02 -1.5100000E-02
 C   0.1719000      -1.387200      -2.294100    
 C  -0.7860000       1.935800       1.253100    
 C    3.768300      0.1936000       1.763700    
 C   -3.269700      0.2831000      0.3267000    
 H    1.167300      0.4796000       1.895400    
 H  -0.9455000       1.719100     -0.8567000    
 H   7.3200002E-02  -1.635100       1.987800    
 H    1.769200      -2.134100       1.932500    
 H    1.670800      -2.534300     -0.4526000    
 H   0.1356000      -3.178600      0.1268000    
 H    3.150900     -0.9265000      5.4499999E-02
 H    3.646700       1.072800      -1.095800    
 H    2.837600       2.110200      0.1286000    
 H   -2.100600      -2.030000     -0.5825000    
 H  -0.2307000      -2.359900      -2.601000    
 H  -0.3500000     -0.6192000      -2.876200    
 H    1.229100      -1.368300      -2.580400    
 H  -0.8508000       1.346500       2.174000    
 H   0.1157000       2.555600       1.292700    
 H   -1.644500       2.616500       1.248200    
 H    3.749000     -0.6600000       2.448600    
 H    4.796500      0.3178000       1.408100    
 H    3.499000       1.089800       2.332800    
 H   -4.789300     -0.7208000       1.013100    


%chk=000176150-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176150

0 1
O 1.009422 1.614435 -2.144916
O -4.197969 -0.815826 0.145911
O -3.836725 1.441357 0.555658
C 0.492321 0.234002 -0.145210
C 1.417802 -0.125574 1.063451
C 0.012534 -1.195134 -0.735053
C -0.836141 1.047565 0.150938
C 1.016795 -1.554488 1.499400
C 0.715098 -2.270980 0.162461
C 2.885817 -0.032377 0.520024
C 1.399519 1.040800 -1.097503
C 2.828608 1.081323 -0.550938
C -1.481286 -1.179091 -0.476313
C -1.941720 0.004969 0.010659
C 0.284348 -1.439829 -2.242617
C -0.861524 1.832030 1.482037
C 3.926841 0.204890 1.629154
C -3.360985 0.313028 0.266968
H 1.312173 0.601557 1.889564
H -0.959338 1.783696 -0.671252
H 0.108038 -1.522764 2.129905
H 1.809377 -2.060216 2.081735
H 1.652349 -2.602803 -0.323362
H 0.081986 -3.167681 0.292599
H 3.129368 -0.986497 0.008916
H 3.574534 0.995203 -1.360098
H 2.976029 2.078993 -0.084050
H -2.116539 -2.042701 -0.700368
H -0.146428 -2.410267 -2.552617
H -0.155545 -0.645022 -2.868361
H 1.370347 -1.471684 -2.449301
H -0.793734 1.162945 2.359351
H -0.026427 2.554766 1.529827
H -1.807589 2.393790 1.556803
H 3.895892 -0.601461 2.385716
H 4.953617 0.242598 1.220908
H 3.734071 1.163055 2.149086
H -5.135734 -0.525408 0.308689


