%chk=000086752.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086752

0 1
 O    2.411600      -1.355600      0.1796000    
 C   -2.367300     -6.8000001E-03  0.3438000    
 C   -1.696900      -1.225500     -0.2984000    
 C  -0.2087000      -1.291500      5.9000000E-02
 C   0.4942000      4.0399998E-02 -2.0700000E-02
 C   -1.681300       1.286000     -0.1261000    
 C    1.993300       0.000000      1.7999999E-02
 C  -0.1833000       1.197100     -0.1189000    
 C   -3.861900      2.8800000E-02  3.2299999E-02
 C    2.520900      0.7859000       1.216300    
 C    2.579500      0.5411000      -1.284700    
 H   -2.253600     -8.5400000E-02   1.433900    
 H   -1.807400      -1.175800      -1.389900    
 H   -2.188300      -2.150500      2.6500000E-02
 H   0.2488000      -2.013700     -0.6278000    
 H  -0.1013000      -1.686700       1.077000    
 H   -1.991900       2.111000      0.5264000    
 H   -2.002500       1.545400      -1.142600    
 H   0.3472000       2.142000     -0.1971000    
 H   -4.357200     -0.8736000      0.4057000    
 H   -4.336500      0.8936000      0.5078000    
 H   -4.043200      9.2200004E-02  -1.046000    
 H    2.101900      0.4022000       2.154600    
 H    3.608600      0.6757000       1.302700    
 H    2.300200       1.856600       1.152900    
 H    2.348100       1.599100      -1.446800    
 H    2.212000     -2.8999999E-02  -2.146700    
 H    3.670700      0.4324000      -1.292100    
 H    3.383800      -1.374600      0.1831000    


%chk=000086752-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086752

0 1
O 2.360499 -1.236497 0.818205
C -2.426242 -0.110108 0.321559
C -1.671762 -1.064200 -0.634758
C -0.200967 -1.248011 -0.201248
C 0.486279 0.077497 0.111576
C -1.750377 1.283123 0.288246
C 2.022502 0.053645 0.137740
C -0.232974 1.213418 0.325508
C -3.928786 -0.017933 -0.015557
C 2.660635 1.208554 0.938949
C 2.592718 0.017515 -1.306442
H -2.318905 -0.514913 1.350536
H -1.711168 -0.643133 -1.661241
H -2.179336 -2.048391 -0.669209
H 0.365026 -1.790260 -0.982781
H -0.138784 -1.894547 0.695844
H -2.111262 1.896468 1.139536
H -2.074943 1.826081 -0.627772
H 0.285115 2.157225 0.542985
H -4.422177 -1.003445 0.079492
H -4.451865 0.688881 0.656523
H -4.076349 0.333831 -1.055433
H 2.269133 1.220118 1.969950
H 3.759105 1.075792 0.982595
H 2.468806 2.191960 0.473870
H 2.325932 0.937480 -1.856385
H 2.194934 -0.849185 -1.861622
H 3.697565 -0.063135 -1.287172
H 3.347145 -1.337029 0.808307


