%chk=000085746.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085746

0 1
 O   -5.258200      -1.996700      6.5800004E-02
 O    5.789400     -0.3512000     -7.2200000E-02
 C   -2.805700      0.6396000     -0.1370000    
 C   -2.246100     -0.4987000      0.7442000    
 C  -0.7089000     -0.5924000      0.8581000    
 C   2.6100000E-02 -0.3812000     -0.4905000    
 C   -2.023800      0.7694000      -1.459100    
 C   -4.247400      0.1570000     -0.3922000    
 C   -2.849100      -1.779400      0.1250000    
 C  -0.5113000      0.8434000      -1.253200    
 C   -4.152300      -1.357600     -0.5520000    
 C  -0.1458000      0.3575000       1.923900    
 C   -2.864300       1.995900      0.5811000    
 C    1.541500     -0.3020000     -0.3236000    
 C    1.343900      0.1038000       2.146300    
 C    2.130400     -9.8200001E-02  0.8748000    
 C   -3.580700       3.028000     -0.2624000    
 C    2.351900     -0.5282000      -1.584500    
 C    3.631900     -7.7799998E-02   1.057100    
 C    3.836600     -0.5387000      -1.384900    
 C    4.414700     -0.3342000     -0.1957000    
 C    6.327300      0.9420000     -0.2691000    
 H   -2.670000     -0.4112000       1.755200    
 H  -0.4770000      -1.611200       1.205400    
 H  -0.1777000      -1.269000      -1.105000    
 H   -2.353900       1.615100      -2.067600    
 H   -2.220800     -0.1070000      -2.091600    
 H   -4.691300      0.6003000      -1.290800    
 H   -4.908500      0.4022000      0.4494000    
 H   -2.179700      -2.206700     -0.6295000    
 H   -3.000500      -2.547100      0.8921000    
 H  -4.3200001E-02  0.9041000      -2.243000    
 H  -0.2451000       1.772100     -0.7354000    
 H   -4.139800      -1.647700      -1.608400    
 H  -0.6765000      0.2299000       2.874800    
 H  -0.2697000       1.402200       1.630700    
 H   -1.869700       2.382300      0.8090000    
 H   -3.385600       1.894400       1.541200    
 H    1.467800     -0.7885000       2.773100    
 H    1.757400      0.9491000       2.709600    
 H   -3.012700       3.326100      -1.147100    
 H   -4.584300       2.722900     -0.5686000    
 H   -3.706300       3.941600      0.3314000    
 H    2.120200      0.2544000      -2.315100    
 H    2.062200      -1.489400      -2.025800    
 H   -6.064400      -1.663600     -0.3641000    
 H    3.919400      0.8980000       1.466500    
 H    3.906500     -0.8396000       1.797400    
 H    4.453500     -0.7202000      -2.260900    
 H    7.415500      0.8751000     -0.1758000    
 H    5.969100       1.645100      0.4905000    
 H    6.099700       1.322500      -1.271100    


%chk=000085746-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085746

0 1
O -5.188249 -2.253573 0.229543
O 5.839976 -0.361031 -0.494602
C -2.888113 0.643718 -0.162977
C -2.205766 -0.452036 0.742723
C -0.650163 -0.456733 0.806827
C 0.009119 -0.279876 -0.591320
C -2.135275 0.745573 -1.523744
C -4.309276 0.037810 -0.373032
C -2.780807 -1.808692 0.230194
C -0.610645 0.926437 -1.357663
C -4.125459 -1.501169 -0.473376
C -0.040744 0.558380 1.804576
C -2.977138 2.026507 0.551850
C 1.535201 -0.197844 -0.503827
C 1.466761 0.285824 1.984671
C 2.192286 0.052111 0.665399
C -3.861795 3.083325 -0.148887
C 2.278355 -0.456119 -1.808246
C 3.710997 0.096756 0.775243
C 3.784764 -0.450640 -1.691782
C 4.426550 -0.213119 -0.521673
C 6.589965 0.535915 0.392408
H -2.582211 -0.294079 1.776404
H -0.355223 -1.463304 1.179005
H -0.230816 -1.181372 -1.200082
H -2.557315 1.576010 -2.122705
H -2.314187 -0.179207 -2.110772
H -4.827425 0.464175 -1.252725
H -4.928568 0.243504 0.523934
H -2.078054 -2.300214 -0.467264
H -2.963261 -2.514444 1.059090
H -0.140673 1.017783 -2.355544
H -0.385003 1.867887 -0.819936
H -4.103234 -1.823365 -1.535926
H -0.559128 0.487555 2.781002
H -0.181725 1.593946 1.441982
H -1.963000 2.449422 0.683251
H -3.372166 1.854365 1.574719
H 1.611909 -0.604074 2.636422
H 1.945974 1.130239 2.523295
H -3.488551 3.330816 -1.159772
H -4.906427 2.737113 -0.249767
H -3.877109 4.022480 0.434718
H 1.965865 0.292768 -2.570182
H 1.938657 -1.431606 -2.225109
H -6.057262 -2.058588 -0.205479
H 4.012567 1.097962 1.157649
H 4.040300 -0.621511 1.560607
H 4.381400 -0.674083 -2.584062
H 7.646700 0.261336 0.251294
H 6.318909 0.394926 1.456836
H 6.443212 1.598536 0.113211


