%chk=000041552.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041552

0 1
 O  -0.7502000      0.8665000     -0.3858000    
 O   -2.407100       1.809100      0.9056000    
 C    1.445800       1.787300     -0.8098000    
 C    2.174100      0.5536000     -0.3341000    
 C   0.1072000       1.978100     -0.1051000    
 C    3.046400      0.6510000      0.7386000    
 C    1.957300     -0.6543000     -0.9781000    
 C    3.719400     -0.4889000       1.178400    
 C    2.630100      -1.794200     -0.5381000    
 C   -2.754900     -0.3092000     -0.1897000    
 C   -1.983800      0.9142000      0.1878000    
 C    3.511200      -1.711400      0.5401000    
 C   -2.494600     -0.9290000      -1.530600    
 C   -3.655400     -0.7377000      0.7139000    
 C   -4.545500      -1.935300      0.6071000    
 H    1.284700       1.707900      -1.892800    
 H    2.075700       2.672200     -0.6569000    
 H  -0.3659000       2.897000     -0.4705000    
 H   0.2530000       2.057900      0.9790000    
 H    3.213300       1.598200       1.243200    
 H    1.273500     -0.7302000      -1.818800    
 H    4.404900     -0.4246000       2.018400    
 H    2.467900      -2.746300      -1.034800    
 H    4.034900      -2.599000      0.8827000    
 H   -3.316600      -1.563900      -1.870800    
 H   -2.368400     -0.1521000      -2.292900    
 H   -1.582600      -1.533600      -1.499900    
 H   -3.768600     -0.1943000       1.650800    
 H   -4.433300      -2.553900       1.503400    
 H   -4.323300      -2.568400     -0.2545000    
 H   -5.590300      -1.616900      0.5425000    


%chk=000041552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041552

0 1
O -0.791867 0.819352 -0.297355
O -2.346802 1.598639 1.251256
C 1.378949 1.832814 -0.745874
C 2.236865 0.625088 -0.393139
C 0.095890 1.948111 0.092722
C 3.265082 0.730701 0.578330
C 2.011271 -0.633870 -1.006714
C 4.047258 -0.392299 0.932731
C 2.792265 -1.758500 -0.657758
C -2.819817 -0.434070 -0.063558
C -2.017065 0.748261 0.383783
C 3.813207 -1.642084 0.314437
C -2.219098 -1.352384 -1.108038
C -4.045768 -0.581529 0.527732
C -5.064926 -1.661902 0.285188
H 1.093076 1.809919 -1.813927
H 1.954763 2.764574 -0.583140
H -0.437402 2.896322 -0.105265
H 0.298660 1.882105 1.176950
H 3.458295 1.699439 1.056951
H 1.216520 -0.728346 -1.755687
H 4.839520 -0.291449 1.683360
H 2.606789 -2.723491 -1.143472
H 4.420603 -2.513396 0.584330
H -2.880850 -2.204531 -1.332183
H -2.025701 -0.804932 -2.048530
H -1.244433 -1.745903 -0.767498
H -4.317715 0.183216 1.270781
H -5.286620 -2.199344 1.228316
H -4.749059 -2.403051 -0.466560
H -6.022990 -1.217657 -0.049868


