%chk=000080361.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080361

0 1
 O    1.794400      -2.867900      2.0900000E-02
 O   -2.248800       2.198700       1.208600    
 O   -2.276200       2.370400      -1.057700    
 C  -0.4794000     -0.2084000     -1.6799999E-02
 C   0.7911000      0.4841000     -1.2700000E-02
 C  -0.2486000      -1.595000     -4.6000001E-03
 C    1.831400     -0.4611000      1.8000000E-03
 C    1.214600      -1.804500      7.4999998E-03
 C   -1.778300      0.2682000     -2.9700000E-02
 C   -1.262100      -2.531800     -4.3000001E-03
 C    1.094400       1.834100     -2.0099999E-02
 C    3.167900     -0.1168000      9.3000000E-03
 C   -2.825600     -0.6616000     -2.9800000E-02
 C   -2.569700      -2.046300     -1.7100001E-02
 C    2.443400       2.210600     -1.2900000E-02
 C    3.468500       1.245200      1.6000000E-03
 C   -2.116900       1.682200     -4.4000000E-02
 H   -1.060500      -3.596200      5.4000001E-03
 H   0.3354000       2.606200     -3.0700000E-02
 H    3.953200     -0.8631000      2.0600000E-02
 H   -3.859800     -0.3231000     -3.9999999E-02
 H   -3.403400      -2.743600     -1.7500000E-02
 H    2.705400       3.265700     -1.8300001E-02
 H    4.506200       1.568200      7.1000000E-03
 H   -2.475600       3.152900       1.187400    


%chk=000080361-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080361

0 1
O 1.799975 -2.950687 -0.141276
O -3.592024 1.924618 0.322256
O -1.456273 2.777528 0.189981
C -0.445448 -0.117887 0.064896
C 0.902667 0.548847 0.001019
C -0.221733 -1.533769 0.015706
C 1.903662 -0.473875 -0.083778
C 1.249965 -1.815709 -0.079333
C -1.796686 0.332090 0.158122
C -1.247329 -2.484378 0.053036
C 1.313747 1.898040 0.010641
C 3.274032 -0.186100 -0.157046
C -2.843097 -0.647145 0.196271
C -2.585079 -2.027684 0.145069
C 2.702165 2.192885 -0.062932
C 3.677599 1.172210 -0.145956
C -2.197220 1.764045 0.219055
H -0.998456 -3.549935 0.010639
H 0.576626 2.698801 0.072644
H 4.000587 -1.002859 -0.220740
H -3.871790 -0.286506 0.267681
H -3.416275 -2.738745 0.176918
H 3.019920 3.241594 -0.055044
H 4.739903 1.432722 -0.201807
H -3.788441 2.899000 0.357979


