%chk=000061455.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061455

0 1
 O   0.9436000      0.2018000     -0.5502000    
 O    2.217900       1.840200      0.4555000    
 C   -2.728900      0.4403000      0.2064000    
 C   -3.958400     -0.3918000     -0.1687000    
 C   -1.427200     -9.8200001E-02 -0.3853000    
 C    3.974600     -0.8815000     -0.1466000    
 C   -5.264400      0.1613000      0.4032000    
 C  -0.2303000      0.7414000      4.1299999E-02
 C    3.257000      0.1826000     -0.9915000    
 C    4.532300     -0.2853000       1.148400    
 C    3.013000      -2.024900      0.1828000    
 C    2.114000      0.8527000     -0.2591000    
 C   -6.443100     -0.7386000      6.3699998E-02
 H   -2.643000      0.4752000       1.299600    
 H   -2.879100       1.473100     -0.1322000    
 H   -4.037300     -0.4448000      -1.261700    
 H   -3.812800      -1.419300      0.1876000    
 H   -1.489200     -0.1182000      -1.480400    
 H   -1.271200      -1.138500     -7.4000001E-02
 H    4.807800      -1.281800     -0.7368000    
 H   -5.183600      0.2515000       1.492500    
 H   -5.446900       1.166400      6.0999999E-03
 H  -0.3620000       1.778000     -0.2905000    
 H  -0.1297000      0.7238000       1.132900    
 H    2.883000     -0.2489000      -1.928000    
 H    3.960700      0.9702000      -1.288100    
 H    3.740100      4.1700002E-02   1.829600    
 H    5.134200      -1.030500       1.680300    
 H    5.178600      0.5725000      0.9350000    
 H    2.209200      -1.710900      0.8566000    
 H    2.560900      -2.432200     -0.7276000    
 H    3.551500      -2.841000      0.6772000    
 H   -7.367300     -0.3248000      0.4791000    
 H   -6.568000     -0.8289000      -1.020100    
 H   -6.303400      -1.741900      0.4788000    


%chk=000061455-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000061455

0 1
O 0.883005 0.220770 -0.618585
O 2.220657 1.630051 0.665891
C -2.842213 0.441052 0.246703
C -4.073383 -0.365612 -0.224288
C -1.525921 -0.040152 -0.408090
C 4.082082 -0.906216 -0.143352
C -5.397054 0.116340 0.412013
C -0.318860 0.752317 0.093448
C 3.258073 0.114972 -0.997974
C 4.879471 -0.213921 0.986045
C 3.187610 -2.040893 0.408810
C 2.118063 0.753525 -0.226187
C -6.621291 -0.699948 -0.055768
H -2.758230 0.366369 1.351019
H -3.000020 1.515716 0.017954
H -4.154504 -0.301604 -1.329459
H -3.922286 -1.439038 0.014668
H -1.595355 0.059520 -1.508490
H -1.368677 -1.114685 -0.192084
H 4.809527 -1.357400 -0.850034
H -5.312730 0.058536 1.516529
H -5.550020 1.187483 0.167809
H -0.404855 1.832899 -0.127758
H -0.164049 0.638483 1.182584
H 2.844933 -0.395706 -1.884371
H 3.933951 0.923294 -1.333679
H 4.203921 0.295304 1.695825
H 5.477282 -0.956868 1.546196
H 5.571586 0.547536 0.581061
H 2.479603 -1.655504 1.166621
H 2.595228 -2.517221 -0.393773
H 3.805351 -2.819630 0.892502
H -7.554011 -0.335632 0.412684
H -6.746379 -0.634076 -1.153135
H -6.507906 -1.769363 0.204467


