%chk=000078539.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078539

0 1
 O  -2.6000001E-02  0.9119000      0.6663000    
 O    1.210000     -0.9228000     -0.2629000    
 O   -2.370300     -0.6479000      0.3685000    
 C   2.9200001E-02 -0.4998000      0.4319000    
 C   -1.189900     -0.9926000     -0.3464000    
 C  -2.6200000E-02   1.712800     -0.5077000    
 C    2.401800     -0.5722000      0.4287000    
 C  -8.6900003E-02   3.172000     -0.1091000    
 C    3.594800      -1.053300     -0.3695000    
 C   -3.536600      -1.108200     -0.2997000    
 H   1.9400001E-02 -0.9732000       1.421300    
 H   -1.222800     -0.5781000      -1.359800    
 H   -1.129200      -2.083100     -0.4539000    
 H   0.8780000       1.527700      -1.096400    
 H  -0.9030000       1.498300      -1.124400    
 H    2.468500      0.5132000      0.5559000    
 H    2.405000      -1.044500       1.417200    
 H  -9.2200004E-02   3.819000     -0.9908000    
 H  -0.9861000       3.373500      0.4825000    
 H   0.7719000       3.435800      0.5171000    
 H    4.531100     -0.8043000      0.1377000    
 H    3.549500      -2.137700     -0.5153000    
 H    3.600700     -0.5982000      -1.365500    
 H   -3.522600      -2.198800     -0.3894000    
 H   -3.617700     -0.6491000      -1.289800    
 H   -4.409200     -0.8181000      0.2916000    


%chk=000078539-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078539

0 1
O -0.022653 1.000631 0.690790
O 1.212093 -0.861133 -0.241066
O -2.396391 -0.613824 0.289209
C 0.015676 -0.434308 0.487583
C -1.139664 -1.025993 -0.331208
C -0.263141 1.814158 -0.522349
C 2.461427 -0.663336 0.526086
C 0.015989 3.267527 -0.140937
C 3.622646 -1.063043 -0.382312
C -3.551774 -1.188008 -0.396551
H 0.017785 -0.831805 1.522367
H -1.080156 -0.678494 -1.385333
H -1.036762 -2.131892 -0.327448
H 0.408346 1.474744 -1.337037
H -1.317197 1.684171 -0.839746
H 2.533870 0.396576 0.839560
H 2.429495 -1.295558 1.440237
H -0.178907 3.935863 -0.999987
H -0.632887 3.575547 0.697052
H 1.067077 3.394875 0.171913
H 4.584190 -0.948963 0.151159
H 3.523032 -2.114470 -0.703462
H 3.645416 -0.427241 -1.284403
H -3.536311 -2.298769 -0.363037
H -3.598209 -0.866059 -1.459567
H -4.441792 -0.818895 0.136589


