%chk=000068068.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068068

0 1
 O   1.4000000E-03  -3.114500     -1.1000000E-03
 C   0.7294000      0.2223000     -4.0000002E-03
 C  -0.7290000      0.2218000      3.3000000E-03
 C    1.206500      -1.035400     -1.4700000E-02
 C   -1.205300      -1.036200      1.4400000E-02
 C   1.0000000E-03  -1.896200     -9.9999997E-05
 C    1.582600       1.420000      1.5000000E-02
 C   -1.583200       1.418700     -1.5300000E-02
 C    2.582400      -1.528100     -1.8400000E-02
 C   -2.580800      -1.529900      1.8400000E-02
 C    1.993200       1.964600       1.231900    
 C   -1.995400       1.964700      -1.232100    
 C    1.981200       2.011700      -1.183600    
 C   -1.983500       2.011100       1.183500    
 C    3.248200      -1.777400       1.187800    
 C   -3.246600      -1.779800      -1.187700    
 C    3.249500      -1.756300      -1.228100    
 C   -3.247500      -1.758200       1.228300    
 C    2.802100       3.100800       1.250100    
 C   -2.805500       3.100200      -1.249900    
 C    2.790300       3.147800      -1.165400    
 C   -2.793700       3.146500       1.165600    
 C    4.561500      -2.247400       1.184500    
 C   -4.559500      -2.250600      -1.184000    
 C    4.562700      -2.226500      -1.231400    
 C   -4.560500      -2.229200       1.231900    
 C    3.200800       3.692200      5.1500000E-02
 C   -3.204600       3.691000     -5.1199999E-02
 C    5.218700      -2.472000     -2.5000000E-02
 C   -5.216400      -2.475400      2.5599999E-02
 H    1.690300       1.515200       2.174600    
 H   -1.692300       1.516100      -2.175100    
 H    1.669100       1.599100      -2.140000    
 H   -1.671300       1.598800       2.140000    
 H    2.750300      -1.607500       2.139800    
 H   -2.748900      -1.609600      -2.139800    
 H    2.752700      -1.569800      -2.177400    
 H   -2.750600      -1.571200       2.177500    
 H    3.121600       3.524800       2.197500    
 H   -3.125300       3.524300      -2.197300    
 H    3.100600       3.608500      -2.098600    
 H   -3.104400       3.606700       2.098900    
 H    5.072300      -2.438400       2.123700    
 H   -5.070500      -2.442200      -2.123000    
 H    5.074700      -2.401300      -2.173100    
 H   -5.072100      -2.404200       2.173700    
 H    3.830700       4.576900      6.5600000E-02
 H   -3.835300       4.575100     -6.5099999E-02
 H    6.241300      -2.837900     -2.7600000E-02
 H   -6.238700      -2.842000      2.8500000E-02


%chk=000068068-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068068

0 1
O 0.001695 -3.197941 -0.000058
C 0.761983 0.263088 0.049798
C -0.761947 0.262307 -0.050233
C 1.226228 -1.040593 0.073536
C -1.224918 -1.041767 -0.074065
C 0.001107 -1.937747 -0.000261
C 1.573422 1.500600 0.107171
C -1.574766 1.498925 -0.106972
C 2.599914 -1.574803 0.045976
C -2.598161 -1.577070 -0.046513
C 2.571509 1.658744 1.110486
C -2.573865 1.655961 -1.109440
C 1.382769 2.551392 -0.833926
C -1.384650 2.549799 0.834138
C 2.911602 -2.789762 0.724078
C -2.908900 -2.792580 -0.724069
C 3.639170 -0.922605 -0.680881
C -3.638076 -0.925008 0.679506
C 3.354904 2.829194 1.168595
C -3.358647 2.825524 -1.166837
C 2.179159 3.715503 -0.783923
C -2.182359 3.713035 0.784812
C 4.219318 -3.318708 0.692401
C -4.216290 -3.322330 -0.692439
C 4.943067 -1.455132 -0.712428
C -4.941654 -1.458313 0.710975
C 3.165855 3.861841 0.218417
C -3.169995 3.858336 -0.216757
C 5.242898 -2.654489 -0.021879
C -5.240501 -2.658326 0.021141
H 2.724590 0.858140 1.841852
H -2.726664 0.855180 -1.840683
H 0.621159 2.447726 -1.613642
H -0.622319 2.446926 1.613262
H 2.123986 -3.317106 1.269066
H -2.120820 -3.319728 -1.268573
H 3.415896 -0.005174 -1.234445
H -3.415552 -0.006991 1.232420
H 4.113413 2.935798 1.952003
H -4.117937 2.931294 -1.949603
H 2.025190 4.508859 -1.523621
H -2.028709 4.506502 1.524458
H 4.437642 -4.251857 1.223671
H -4.433874 -4.255930 -1.223223
H 5.724666 -0.940228 -1.282482
H -5.723776 -0.943491 1.280385
H 3.778612 4.769232 0.261180
H -3.783822 4.765027 -0.258976
H 6.257585 -3.067551 -0.047245
H -6.254940 -3.072000 0.046445


