%chk=000080498.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080498

0 1
 O    2.435200     -0.4593000       0.000000    
 O    2.261400       1.836100     -2.0000001E-03
 O   -4.389500      -1.327800     -1.3000000E-03
 C   0.2987000      0.4823000      7.9999998E-04
 C  -0.5836000       1.562600      1.3000000E-03
 C  -0.1958000     -0.8220000      1.9999999E-04
 C   -2.454900      3.4200002E-02  3.0000001E-04
 C   -1.960300       1.338600      1.2000001E-03
 C   -1.572500      -1.046100     -1.9999999E-04
 C    1.734000      0.7158000     -8.9999998E-04
 C    3.863400     -0.3606000     -1.9999999E-04
 C    4.453900      -1.754600      8.9999998E-04
 C   -3.890100     -0.1992000       0.000000    
 H  -0.2193000       2.586600      1.5000000E-03
 H   0.4534000      -1.693200     -6.0000003E-04
 H   -2.635300       2.190700      1.5000000E-03
 H   -1.935700      -2.070500     -8.9999998E-04
 H    4.190200      0.1808000     -0.8947000    
 H    4.190400      0.1823000      0.8934000    
 H    5.546800      -1.716400      6.9999998E-04
 H    4.119400      -2.313900      0.8809000    
 H    4.119200      -2.315300     -0.8781000    
 H   -4.537100      0.6946000      6.9999998E-04


%chk=000080498-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080498

0 1
O 2.484446 -0.505762 0.002724
O 2.272291 1.815922 0.000861
O -4.584273 -1.268196 -0.002363
C 0.270946 0.417691 0.002945
C -0.596118 1.540940 0.000787
C -0.264270 -0.899835 0.003421
C -2.528170 0.033786 -0.000142
C -1.989809 1.348043 -0.000702
C -1.656624 -1.089266 0.001929
C 1.744142 0.675899 0.004698
C 3.972242 -0.343184 -0.000043
C 4.569459 -1.745573 -0.001805
C -4.003363 -0.150787 -0.001707
H -0.154955 2.542570 0.000446
H 0.421885 -1.750696 0.005069
H -2.666841 2.211169 -0.002296
H -2.098276 -2.091472 0.002322
H 4.252185 0.241433 -0.894870
H 4.255520 0.240622 0.894265
H 5.672559 -1.679381 -0.003818
H 4.258332 -2.309607 0.893896
H 4.255011 -2.308787 -0.896861
H -4.594419 0.800172 -0.004256


