%chk=000070332.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070332

0 1
 O    2.113700       1.005200      0.6744000    
 O    3.023400     -0.8184000     -0.4935000    
 O   -2.902400      0.4143000      3.5000000E-02
 O   -1.972700      -1.696600      8.7600000E-02
 C    1.926600      0.1075000     -0.4317000    
 C   0.6289000     -0.6621000     -0.2197000    
 C    3.463300      0.7937000       1.087500    
 C    3.708900     -0.6505000      0.7470000    
 C    1.890700      0.9065000      -1.728400    
 C  -0.5748000      0.2743000     -0.1894000    
 C   -1.871500     -0.4812000     -7.0000002E-03
 C   -4.205000     -0.1536000      0.2060000    
 C   -5.229200      0.9608000      0.2322000    
 H   0.6787000      -1.217200      0.7265000    
 H   0.5077000      -1.421100      -1.003400    
 H    3.582300       1.015500       2.150800    
 H    4.106700       1.460800      0.5036000    
 H    4.768000     -0.8976000      0.6409000    
 H    3.252000      -1.321400       1.482400    
 H    1.219800       1.769000      -1.674100    
 H    2.887300       1.309300      -1.947000    
 H    1.615600      0.2765000      -2.580700    
 H  -0.6703000      0.8207000      -1.132700    
 H  -0.4826000      0.9887000      0.6359000    
 H   -4.419000     -0.8336000     -0.6260000    
 H   -4.239500     -0.7104000       1.149100    
 H   -6.238800      0.5612000      0.3620000    
 H   -5.017700       1.659500       1.048400    
 H   -5.194200       1.538300     -0.6976000    


%chk=000070332-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070332

0 1
O 2.182569 1.056038 0.592316
O 3.079817 -0.763595 -0.649392
O -2.953835 0.420984 0.001528
O -1.827202 -1.422642 0.873129
C 1.961683 0.211978 -0.627380
C 0.623037 -0.530456 -0.448039
C 3.445554 0.610136 1.222746
C 3.587793 -0.843245 0.736888
C 2.074404 1.066988 -1.888567
C -0.562208 0.422566 -0.194600
C -1.799720 -0.316595 0.283698
C -4.244380 -0.170207 0.475309
C -5.349992 0.791261 0.051660
H 0.712902 -1.222346 0.408218
H 0.439161 -1.147728 -1.346858
H 3.326146 0.710473 2.313930
H 4.287595 1.237738 0.871461
H 4.626588 -1.203361 0.680561
H 2.974719 -1.538608 1.343711
H 1.296721 1.848951 -1.897228
H 3.063113 1.552704 -1.922078
H 1.958494 0.437043 -2.787757
H -0.828130 1.017800 -1.084987
H -0.272513 1.142410 0.597006
H -4.354259 -1.171975 0.021913
H -4.187684 -0.295338 1.571991
H -6.331295 0.401901 0.379233
H -5.201949 1.786326 0.504968
H -5.371227 0.908898 -1.045280


