%chk=000041819.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041819

0 1
 O    4.373100       1.893200      0.2494000    
 O   -4.839400       1.164600      3.0600000E-02
 C   1.6100001E-02  -1.689400      0.3608000    
 C   0.1332000      -2.876000     -0.6538000    
 C    1.196200     -0.7194000      0.3305000    
 C   -1.298600     -0.9164000      0.2713000    
 C    1.390300      -3.721300     -0.3922000    
 C   -1.089100      -3.805400     -0.5803000    
 C    1.607900     -0.1430000       1.511000    
 C   -2.160400     -0.9523000       1.344300    
 C    1.804800     -0.4569000     -0.8763000    
 C   -1.573800     -0.2117000     -0.8793000    
 C    2.685100      0.7428000       1.483400    
 C   -3.360900     -0.2467000       1.262700    
 C    2.882000      0.4289000     -0.9041000    
 C   -2.774300      0.4940000     -0.9611000    
 C    3.322300       1.028700      0.2759000    
 C   -3.667900      0.4766000      0.1100000    
 C    5.365000       1.679300     -0.7536000    
 C   -4.847300       2.342900     -0.7740000    
 C    6.700600       2.172900     -0.2397000    
 C   -5.865000       3.314500     -0.2157000    
 H   4.8000000E-02  -2.168800       1.352300    
 H   0.1715000      -2.510100      -1.686100    
 H    2.311500      -3.148300     -0.5266000    
 H    1.437000      -4.567800      -1.086500    
 H    1.389000      -4.125000      0.6263000    
 H   -1.235100      -4.189100      0.4352000    
 H  -0.9644000      -4.664300      -1.249100    
 H   -2.005500      -3.292700     -0.8883000    
 H    1.117300     -0.3585000       2.455200    
 H   -1.932600      -1.511900       2.246100    
 H    1.479400     -0.8834000      -1.817400    
 H  -0.9035000     -0.2014000      -1.731700    
 H    3.023300       1.207200       2.405700    
 H   -4.053100     -0.2640000       2.100000    
 H    3.330100      0.6485000      -1.868700    
 H   -2.988700       1.018600      -1.887400    
 H    5.478500      0.6149000     -0.9950000    
 H    5.088000       2.233100      -1.657500    
 H   -3.873100       2.847800     -0.7683000    
 H   -5.115800       2.075000      -1.801800    
 H    7.484600       2.033700     -0.9893000    
 H    6.645000       3.235300      1.9600000E-02
 H    6.984700       1.637600      0.6725000    
 H   -5.905400       4.227700     -0.8163000    
 H   -6.861300       2.860500     -0.1964000    
 H   -5.617400       3.581500      0.8171000    


%chk=000041819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041819

0 1
O 4.817979 1.468307 0.449134
O -4.732339 1.500168 0.275191
C 0.030775 -1.800481 0.431346
C -0.025851 -2.962030 -0.624094
C 1.323238 -0.970629 0.370911
C -1.209565 -0.892649 0.361997
C 1.165763 -3.934261 -0.447637
C -1.358092 -3.743830 -0.538618
C 1.855128 -0.421418 1.569217
C -2.234272 -0.997944 1.339671
C 2.000098 -0.675739 -0.836560
C -1.385390 0.055971 -0.673523
C 3.008825 0.382181 1.567483
C -3.389305 -0.195071 1.287980
C 3.162913 0.129491 -0.863454
C -2.538996 0.869122 -0.748500
C 3.671231 0.662247 0.346244
C -3.547837 0.743815 0.239557
C 5.548948 1.782778 -0.792731
C -4.936687 2.502192 -0.787435
C 6.738552 2.653305 -0.396003
C -6.279078 3.173944 -0.509791
H 0.008926 -2.296119 1.425637
H 0.029950 -2.510925 -1.637437
H 2.138277 -3.418775 -0.525887
H 1.134774 -4.731843 -1.213174
H 1.120230 -4.421266 0.546108
H -1.483147 -4.196178 0.464929
H -1.370761 -4.564273 -1.280098
H -2.230291 -3.095072 -0.727739
H 1.349286 -0.624997 2.521240
H -2.126173 -1.722956 2.155934
H 1.634039 -1.087935 -1.784153
H -0.602579 0.183412 -1.429936
H 3.415576 0.800712 2.493388
H -4.176088 -0.275192 2.044600
H 3.656238 0.325864 -1.820232
H -2.631852 1.592547 -1.564419
H 5.882949 0.840150 -1.274354
H 4.875189 2.317388 -1.494354
H -4.106329 3.238261 -0.766248
H -4.936096 1.998888 -1.776746
H 7.327192 2.925542 -1.291045
H 6.394910 3.580631 0.093269
H 7.397002 2.114743 0.306660
H -6.489949 3.936874 -1.281258
H -7.094588 2.430731 -0.519251
H -6.270823 3.666318 0.477580


