%chk=000071941.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071941

0 1
 O    2.414200     -0.2206000      0.9666000    
 O    1.307200       2.292600      0.5426000    
 O   -6.130800      -1.465700      6.0999999E-03
 O   -5.829200      0.6101000     -0.8911000    
 C    4.629300     -0.4710000      9.2900001E-02
 C    5.528100      -1.245800     -0.8667000    
 C    3.198900     -0.9907000      6.6699997E-02
 C    1.082900     -8.7200001E-02  0.6682000    
 C    6.945400     -0.6958000     -0.8692000    
 C   0.5350000       1.173600      0.4586000    
 C   0.2909000      -1.226900      0.5797000    
 C   -1.621600      0.1574000      6.6699997E-02
 C  -0.8214000       1.296200      0.1568000    
 C   -1.065400      -1.104300      0.2781000    
 C   -3.035800      0.2853000     -0.2474000    
 C    1.940500       2.734800     -0.6564000    
 C   -3.979700     -0.6490000      3.7000000E-03
 C   -5.388700     -0.3931000     -0.3559000    
 H    5.021500     -0.5337000       1.115600    
 H    4.632100      0.5958000     -0.1634000    
 H    5.122200      -1.192000      -1.883600    
 H    5.551700      -2.304100     -0.5822000    
 H    2.802500     -0.9214000     -0.9548000    
 H    3.173300      -2.040200      0.3815000    
 H    6.958900      0.3528000      -1.183500    
 H    7.393400     -0.7618000      0.1274000    
 H    7.572100      -1.266000      -1.562000    
 H   0.7105000      -2.215000      0.7466000    
 H   -1.244400       2.285600     -4.4000000E-03
 H   -1.645100      -2.019400      0.2009000    
 H   -3.328200       1.225100     -0.7114000    
 H    1.190000       3.045700      -1.390000    
 H    2.571800       1.946800      -1.078000    
 H    2.570300       3.595200     -0.4141000    
 H   -3.759300      -1.594500      0.4861000    
 H   -7.079800      -1.346600     -0.2123000    


%chk=000071941-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071941

0 1
O 2.478909 0.393564 -0.145611
O 0.942003 2.709640 0.475561
O -6.229732 -1.868376 -0.056931
O -6.154772 0.407856 0.433339
C 4.750395 -0.434351 -0.280758
C 5.689788 -1.648505 -0.470965
C 3.276231 -0.835322 -0.356336
C 1.085073 0.282139 -0.118607
C 7.180152 -1.252498 -0.401457
C 0.347118 1.474383 0.172568
C 0.380433 -0.930602 -0.340159
C -1.770118 0.192702 0.059773
C -1.054674 1.407421 0.261877
C -1.021090 -0.976761 -0.251560
C -3.229104 0.210421 0.173975
C 1.928189 3.258972 -0.478884
C -4.089410 -0.844104 0.006181
C -5.538702 -0.654695 0.156129
H 4.943336 0.042266 0.699304
H 4.959738 0.326315 -1.057533
H 5.481612 -2.130034 -1.448322
H 5.473246 -2.409484 0.306141
H 3.031240 -1.268638 -1.348154
H 3.021926 -1.574156 0.431216
H 7.431082 -0.513494 -1.185179
H 7.425568 -0.800621 0.577602
H 7.835622 -2.130760 -0.542409
H 0.929362 -1.848028 -0.570237
H -1.588271 2.333927 0.500723
H -1.532781 -1.929273 -0.421944
H -3.690079 1.178150 0.421553
H 1.469715 3.378468 -1.479646
H 2.818790 2.613803 -0.544897
H 2.192765 4.245791 -0.070005
H -3.756442 -1.856130 -0.241623
H -7.203817 -1.697788 0.053674


