%chk=000108238.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108238

0 1
 O   -1.191500       1.312900      0.2839000    
 O    1.562500       1.453600      0.5380000    
 O   -3.431200     -0.3068000     -0.1450000    
 O    1.583700      -1.111100      0.1885000    
 O    3.599400      -1.129400     -0.9306000    
 C  -0.5322000       2.578200      0.2769000    
 C   0.8735000       2.382400     -0.2765000    
 C   -2.274700       1.300300       1.200600    
 C   -1.336400       3.547200     -0.5766000    
 C   -2.936300     -6.3900001E-02   1.166300    
 C    1.487400      -2.532900      5.3100001E-02
 C    2.646000      0.9242000     -0.1312000    
 C   -4.044200      -1.584800     -0.2416000    
 C   2.1900000E-02  -2.928400     -4.6799999E-02
 C    2.173900      -3.196400       1.237300    
 C    2.696100     -0.5432000     -0.3524000    
 C   -4.549000      -1.784100      -1.654800    
 C    3.650900       1.682200     -0.5889000    
 H  -0.4442000       2.954900       1.304300    
 H    1.401800       3.343400     -0.2843000    
 H   0.7970000       2.004800      -1.306300    
 H   -3.015700       2.055900      0.9230000    
 H   -1.911600       1.503600       2.214200    
 H   -1.551800       3.117900      -1.561300    
 H   -2.299700       3.790300     -0.1191000    
 H  -0.7954000       4.488600     -0.7174000    
 H   -3.760500     -9.8099999E-02   1.887200    
 H   -2.201600     -0.8366000       1.418900    
 H    1.971100      -2.863000     -0.8751000    
 H   -3.315100      -2.365600      2.4000001E-03
 H   -4.882000      -1.648100      0.4618000    
 H  -0.5250000      -2.627000      0.8530000    
 H  -9.2399999E-02  -4.008400     -0.1797000    
 H  -0.4553000      -2.418000     -0.8904000    
 H    1.725600      -2.868500       2.181700    
 H    2.104100      -4.286800       1.176900    
 H    3.232600      -2.920000       1.279900    
 H   -5.270300      -1.004200      -1.920300    
 H   -3.724600      -1.712500      -2.372000    
 H   -5.028500      -2.760700      -1.764700    
 H    3.663800       2.756200     -0.4355000    
 H    4.499500       1.259500      -1.116700    


%chk=000108238-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000108238

0 1
O -1.668835 0.767856 -0.485712
O 1.288445 0.560963 -0.081375
O -4.668936 0.340539 -0.827828
O 2.515557 -1.500282 0.915776
O 4.329086 -1.329242 -0.544507
C -0.793330 1.767034 0.156595
C 0.534007 1.717498 -0.597650
C -2.615621 0.135138 0.439046
C -1.440049 3.164209 0.090338
C -3.651967 -0.616829 -0.384008
C 3.152288 -2.709400 1.560746
C 2.506259 0.284512 -0.697034
C -5.618005 -0.251608 -1.779440
C 1.985334 -3.507778 2.144417
C 4.171956 -2.231442 2.604420
C 3.220178 -0.911515 -0.122617
C -6.624454 0.833547 -2.160974
C 3.080591 0.974534 -1.725322
H -0.601573 1.476986 1.211919
H 1.125119 2.641866 -0.432899
H 0.340431 1.590714 -1.681556
H -3.136710 0.889365 1.066110
H -2.066839 -0.567270 1.103347
H -1.534077 3.499140 -0.958121
H -2.455047 3.135517 0.522955
H -0.844743 3.908455 0.651787
H -4.125041 -1.413134 0.234741
H -3.150648 -1.096759 -1.252459
H 3.667857 -3.269709 0.758306
H -5.069634 -0.619123 -2.675823
H -6.131440 -1.123708 -1.312758
H 1.446830 -2.912088 2.902283
H 2.363439 -4.428124 2.625319
H 1.270993 -3.792429 1.353379
H 3.679621 -1.601963 3.366764
H 4.626047 -3.102447 3.111702
H 4.979796 -1.652815 2.126284
H -7.167801 1.188513 -1.268180
H -6.104425 1.695069 -2.614079
H -7.359245 0.442811 -2.888499
H 2.620782 1.849276 -2.190182
H 4.045403 0.631723 -2.104510


