%chk=000075689.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075689

0 1
 O   -3.776600     -0.4732000      0.1378000    
 O   0.4466000      -1.563000       2.055500    
 O    2.183900      -2.215200     -0.7576000    
 C   0.2914000     -0.9365000     -0.2538000    
 C    1.768000      -1.097600     -0.4174000    
 C  -0.2848000      -1.177600      0.9722000    
 C    2.700900     -4.9999999E-03 -0.1933000    
 C  -0.4373000     -0.5462000      -1.354800    
 C   -2.430500     -0.6260000      8.1000002E-03
 C   -1.664400      -1.020100       1.105200    
 C   -1.816900     -0.3891000      -1.222000    
 C    2.226900       1.249700      0.1895000    
 C    4.070200     -0.2118000     -0.3612000    
 C    3.122200       2.297500      0.4047000    
 C    4.965400      0.8359000     -0.1458000    
 C    4.491400       2.090600      0.2372000    
 C   -4.403900      0.4960000     -0.7006000    
 C   -5.627800       1.004400     -1.3800000E-02
 C   -5.824500       2.287200      0.3100000    
 H   3.5300002E-02 -0.3665000      -2.315900    
 H   -2.150600      -1.202500       2.060400    
 H   -2.379300     -0.1082000      -2.107500    
 H    1.170200       1.454700      0.3318000    
 H    4.465400      -1.179400     -0.6590000    
 H    2.753600       3.274700      0.7030000    
 H    6.031600      0.6752000     -0.2762000    
 H    5.188400       2.906500      0.4049000    
 H   -3.734000       1.338600     -0.9172000    
 H   -4.696800      1.8800000E-02  -1.642800    
 H  -0.1483000      -1.677800       2.816300    
 H   -6.401300      0.2809000      0.2299000    
 H   -6.738200       2.593600      0.8075000    
 H   -5.086000       3.049700      8.8500001E-02


%chk=000075689-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000075689

0 1
O -3.733974 0.263735 0.507107
O 0.844017 -0.497083 1.803935
O 1.945990 -1.320652 -2.031761
C 0.336612 -0.333089 -0.561624
C 1.748323 -0.592595 -1.005274
C -0.106550 -0.284643 0.795030
C 2.915718 0.049915 -0.315132
C -0.653797 -0.221581 -1.570898
C -2.419684 0.058259 0.075178
C -1.466663 -0.089053 1.110079
C -2.014933 -0.013821 -1.283967
C 2.792414 1.267190 0.403752
C 4.198205 -0.541104 -0.467542
C 3.932760 1.882353 0.961639
C 5.334438 0.062640 0.106727
C 5.204643 1.278212 0.821686
C -4.790177 0.366540 -0.530031
C -6.107978 0.485444 0.185951
C -7.026321 1.446344 -0.077162
H -0.319272 -0.304502 -2.610167
H -1.815437 -0.061304 2.149091
H -2.732003 0.090776 -2.101789
H 1.808738 1.736095 0.510821
H 4.277595 -1.468360 -1.044634
H 3.833185 2.829447 1.503577
H 6.318870 -0.405343 -0.004075
H 6.088849 1.753120 1.262239
H -4.601023 1.245581 -1.177194
H -4.761184 -0.552577 -1.153278
H 0.419055 -0.491345 2.697632
H -6.306804 -0.287161 0.940507
H -7.991216 1.471575 0.440189
H -6.842196 2.235286 -0.817012


