%chk=000095394.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095394

0 1
 O    2.400100      0.9569000      8.7399997E-02
 O    1.823100      -1.349000      8.5800000E-02
 C    3.802900      0.6729000      0.1009000    
 C    4.054100     -0.6829000     -0.5626000    
 C    3.192100      -1.752500      9.6199997E-02
 C    1.658500     -8.3600000E-02  0.7287000    
 C    4.520600       1.794400     -0.6350000    
 C   0.2135000      0.2716000      0.6661000    
 C  -0.7118000     -0.4989000      7.3799998E-02
 C   -2.147200     -0.1835000     -1.9500000E-02
 C   -2.566700       1.127400      0.1423000    
 C   -3.052200      -1.203600     -0.2672000    
 C   -3.926400       1.426000      5.4099999E-02
 C   -4.411800     -0.9050000     -0.3558000    
 C   -4.849000      0.4098000     -0.1952000    
 H    4.146600      0.6555000       1.142900    
 H    5.113200     -0.9564000     -0.5143000    
 H    3.766500     -0.6194000      -1.619900    
 H    3.271800      -2.696300     -0.4520000    
 H    3.507300      -1.937600       1.129700    
 H    1.957100     -0.1600000       1.782600    
 H    5.602500       1.631300     -0.6508000    
 H    4.162100       1.880700      -1.666600    
 H    4.319200       2.756600     -0.1519000    
 H  -5.3399999E-02   1.201900       1.158700    
 H  -0.4372000      -1.441100     -0.3931000    
 H   -1.883200       1.952500      0.3153000    
 H   -2.728000      -2.233200     -0.3931000    
 H   -4.267000       2.450300      0.1740000    
 H   -5.130300      -1.696100     -0.5497000    
 H   -5.907500      0.6426000     -0.2652000    


%chk=000095394-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095394

0 1
O 2.474302 0.982238 -0.031569
O 1.851182 -1.368781 -0.030338
C 3.925458 0.659882 0.077635
C 4.184105 -0.720814 -0.566555
C 3.267141 -1.780376 0.075274
C 1.659643 -0.066753 0.602724
C 4.673196 1.810575 -0.592716
C 0.221442 0.354619 0.499794
C -0.789683 -0.488618 0.157482
C -2.223560 -0.152494 0.048901
C -2.737704 1.161738 0.246252
C -3.144659 -1.189860 -0.270897
C -4.117499 1.422333 0.131836
C -4.527321 -0.930810 -0.385720
C -5.021482 0.378058 -0.183764
H 4.184005 0.606883 1.162445
H 5.245502 -1.009973 -0.435985
H 3.970717 -0.656191 -1.649299
H 3.326771 -2.751714 -0.440447
H 3.529397 -1.922088 1.148357
H 1.998720 -0.150785 1.669371
H 5.765052 1.647256 -0.539720
H 4.378270 1.889454 -1.653765
H 4.434707 2.767129 -0.096923
H 0.053605 1.411504 0.738322
H -0.517819 -1.528149 -0.068352
H -2.054961 1.985113 0.483852
H -2.765168 -2.207060 -0.429454
H -4.493285 2.440486 0.285097
H -5.216727 -1.746086 -0.632530
H -6.093848 0.584585 -0.272705


