%chk=000082631.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082631

0 1
 O   -4.523400     -0.3863000       0.000000    
 O    3.643900       1.481200     -1.9999999E-04
 C  -0.4774000      0.6215000      9.9999997E-05
 C  -0.8672000     -0.7389000       0.000000    
 C    1.858100     -5.9799999E-02   0.000000    
 C   0.8894000      0.9443000     -1.9999999E-04
 C   0.1213000      -1.736500     -1.9999999E-04
 C    1.474700      -1.397700     -1.9999999E-04
 C   -1.465800       1.619300     -9.9999997E-05
 C   -2.234100      -1.061500       0.000000    
 C   -3.202800     -5.7300001E-02  3.0000001E-04
 C   -2.819300       1.280700       0.000000    
 C    3.269400      0.2916000      1.9999999E-04
 C    4.333200     -0.8007000      3.0000001E-04
 H    1.186800       1.991700     -1.9999999E-04
 H  -0.1559000      -2.788700     -3.0000001E-04
 H    2.194900      -2.209900     -1.9999999E-04
 H   -1.189400       2.671700     -3.0000001E-04
 H   -2.543400      -2.105300     -9.9999997E-05
 H   -3.569400       2.066900       0.000000    
 H    4.248200      -1.411700     -0.9021000    
 H    4.247700      -1.412100      0.9024000    
 H    5.324000     -0.3352000      7.9999998E-04
 H   -4.607800      -1.355200      9.9999997E-05


%chk=000082631-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000082631

0 1
O -4.618192 -0.304561 0.000071
O 3.670750 1.554418 0.000027
C -0.476778 0.611111 -0.000099
C -0.887824 -0.781940 -0.000096
C 1.895239 -0.077413 -0.000199
C 0.911842 0.927866 -0.000156
C 0.129731 -1.794823 -0.000154
C 1.481043 -1.454755 -0.000192
C -1.490956 1.629933 -0.000044
C -2.281733 -1.100576 -0.000026
C -3.235572 -0.075525 0.000039
C -2.842627 1.301918 0.000022
C 3.340492 0.330040 -0.000265
C 4.411872 -0.757280 0.000315
H 1.243850 1.973004 -0.000167
H -0.172117 -2.849012 -0.000151
H 2.235156 -2.248597 -0.000231
H -1.184317 2.682108 -0.000045
H -2.592556 -2.154210 -0.000034
H -3.624343 2.066601 0.000061
H 4.321131 -1.405936 -0.891177
H 4.320179 -1.406046 0.891624
H 5.403964 -0.281020 0.000849
H -4.822533 -1.273204 0.000129


