%chk=000040303.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040303

0 1
 O   -3.409900       1.629000      -1.579000    
 O   -1.960500     -0.5722000      -1.421000    
 O    2.855200      -1.626400      -1.169100    
 O    5.590100       1.370800     -0.1738000    
 C  -0.9172000      -1.914200      0.9360000    
 C   -1.712700     -0.5981000      0.9883000    
 C   0.3801000      -1.856500      9.9200003E-02
 C   -3.080200       1.215300     -0.2617000    
 C   -4.364200       1.011100      0.5647000    
 C   -2.235800     -5.6699999E-02 -0.3385000    
 C   -1.788000      -3.091800      0.4835000    
 C    1.370300     -0.7587000      0.4973000    
 C   -5.152400       2.321600      0.6591000    
 C   -5.270700     -8.1600003E-02 -1.2900000E-02
 C    2.665300     -0.7666000     -0.3082000    
 C    3.692100      0.2499000     -2.1400001E-02
 C    3.635300       1.262100      0.9300000    
 C    4.873500      0.3307000     -0.6750000    
 C    4.829600       1.932300      0.8024000    
 H  -0.6155000      -2.130300       1.970700    
 H   -2.569600     -0.7654000       1.648500    
 H   -1.103300      0.1882000       1.447100    
 H   0.1447000      -1.758500     -0.9667000    
 H   0.8888000      -2.826000      0.1926000    
 H   -2.457200       2.000300      0.1807000    
 H   -4.098200      0.7240000       1.588000    
 H   -2.696100      -3.160400       1.091800    
 H   -2.087300      -3.002200     -0.5648000    
 H   -1.244200      -4.036300      0.5935000    
 H    1.627500     -0.8714000       1.556700    
 H   0.9070000      0.2231000      0.3520000    
 H   -6.027100       2.200000       1.307400    
 H   -5.507600       2.654300     -0.3219000    
 H   -4.532000       3.117400       1.084600    
 H   -4.748300      -1.040500     -8.4899999E-02
 H   -5.647700      0.1798000      -1.006800    
 H   -6.140400     -0.2343000      0.6360000    
 H   -3.880900      0.9038000      -2.022100    
 H    2.848300       1.500900       1.630600    
 H    5.350500     -0.2239000      -1.470200    
 H    5.266800       2.783200       1.304100    


%chk=000040303-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040303

0 1
O -3.515410 1.947538 -1.314092
O -1.960164 -0.193552 -1.361768
O 3.052283 -2.058918 -0.861792
O 5.860237 1.110860 -0.209085
C -0.889923 -1.767294 0.943220
C -1.601522 -0.390819 1.065708
C 0.362207 -1.770756 0.025850
C -3.269801 1.324091 -0.022584
C -4.614905 0.826761 0.615269
C -2.243436 0.184670 -0.187138
C -1.882786 -2.873446 0.511383
C 1.430623 -0.732124 0.415124
C -5.546672 2.040157 0.833397
C -5.293086 -0.252499 -0.258373
C 2.800725 -0.995050 -0.222589
C 3.842196 0.048972 -0.044373
C 3.760052 1.320785 0.664950
C 5.135506 -0.028398 -0.554293
C 4.989936 1.932312 0.546194
H -0.541090 -2.008552 1.971860
H -2.374931 -0.442148 1.858156
H -0.882569 0.378458 1.423792
H 0.054343 -1.608851 -1.021313
H 0.822972 -2.775577 0.065632
H -2.837784 2.092988 0.653156
H -4.370978 0.390723 1.607173
H -2.762083 -2.915760 1.182235
H -2.238884 -2.699339 -0.519394
H -1.392732 -3.863691 0.535227
H 1.581693 -0.719137 1.518027
H 1.115001 0.294856 0.140549
H -6.515859 1.716429 1.255213
H -5.732059 2.547816 -0.128918
H -5.099058 2.776198 1.527639
H -4.661647 -1.151934 -0.381924
H -5.511637 0.154022 -1.261920
H -6.248634 -0.568848 0.197083
H -3.107880 1.342006 -1.999044
H 2.896646 1.721366 1.192162
H 5.653110 -0.777965 -1.144740
H 5.416098 2.869454 0.891142


