%chk=000085558.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085558

0 1
 O    2.464800       1.448700      0.5754000    
 O    2.488100      -1.437600     -0.4968000    
 O   0.8335000       2.681200     -0.4248000    
 O   0.8043000      -2.696200      0.3760000    
 C  -0.6006000     -3.8000001E-03 -2.2399999E-02
 C   -1.527800     -0.9997000      0.7107000    
 C   -1.552300      0.9585000     -0.7733000    
 C   -2.898300     -0.3383000      0.7133000    
 C   -2.943700      0.3526000     -0.6367000    
 C   0.2614000      0.7743000      0.9818000    
 C   0.3173000     -0.7450000      -1.002200    
 C    1.171900       1.749900      0.2901000    
 C    1.181500      -1.744600     -0.2911000    
 H   -1.198500      -1.236500       1.727800    
 H   -1.617300      -1.944700      0.1605000    
 H   -1.285100       1.099700      -1.825900    
 H   -1.577500       1.950100     -0.3059000    
 H   -2.965500      0.3976000       1.523000    
 H   -3.708700      -1.062100      0.8383000    
 H   -3.115000     -0.3808000      -1.433600    
 H   -3.732900       1.107900     -0.6926000    
 H  -0.3609000       1.348500       1.680000    
 H   0.8522000      9.4800003E-02   1.608500    
 H  -0.2691000      -1.301100      -1.745100    
 H   0.9366000     -5.1300000E-02  -1.583200    
 H    3.089100       2.066000      0.1379000    
 H    3.087500      -2.069200     -4.4900000E-02


%chk=000085558-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085558

0 1
O 1.615911 2.804418 1.438255
O 1.635153 -2.792338 -1.426754
O 1.595416 2.045512 -0.747657
O 1.608637 -2.028883 0.757503
C -0.487985 0.000557 0.001360
C -1.453919 -0.975565 0.776969
C -1.457502 0.970531 -0.777740
C -2.863035 -0.335506 0.698018
C -2.862975 0.322091 -0.702657
C 0.381126 0.782824 1.025976
C 0.389831 -0.776006 -1.019955
C 1.228035 1.894680 0.442055
C 1.241680 -1.882423 -0.432897
H -1.113805 -1.159518 1.810995
H -1.474401 -1.959159 0.268459
H -1.115340 1.155772 -1.810857
H -1.485173 1.954391 -0.270084
H -2.983699 0.442721 1.477602
H -3.672924 -1.073622 0.837815
H -2.976675 -0.456993 -1.482440
H -3.676908 1.055282 -0.844874
H -0.260575 1.224784 1.809661
H 1.064906 0.077474 1.539778
H -0.246003 -1.221928 -1.806154
H 1.071011 -0.066242 -1.531159
H 2.205889 3.497400 1.032589
H 2.228325 -3.481355 -1.019007


