%chk=000126863.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126863

0 1
 O   -1.913600     -0.2659000      -1.449800    
 O    2.532900      2.3900000E-02  -1.422700    
 O   -4.014600      0.7922000      5.6699999E-02
 C    1.073700     -5.1000002E-03  0.4834000    
 C   -1.857000     -0.2306000     -2.0700000E-02
 C   0.4426000      -1.324300      2.1299999E-02
 C   0.2537000       1.194200     -7.4999998E-03
 C   -1.022600      -1.430300      0.4506000    
 C   -1.210900       1.091000      0.4231000    
 C    2.520300      9.7999997E-02  3.4000000E-03
 C   -3.289400     -0.3363000      0.5057000    
 C    3.361700      -1.051100      0.5572000    
 C    3.123100       1.444300      0.3992000    
 H    1.062000      9.8000001E-03   1.582900    
 H   0.9656000      -2.179300      0.4630000    
 H   0.5169000      -1.442900      -1.065700    
 H   0.3152000       1.298300      -1.096900    
 H   0.6365000       2.128500      0.4177000    
 H   -1.434600      -2.359800      3.7999999E-02
 H   -1.068900      -1.511300       1.544100    
 H   -1.271800       1.189500       1.514500    
 H   -1.743300       1.945400     -1.2600000E-02
 H   -3.319400     -0.3541000       1.599600    
 H   -3.791900      -1.232200      0.1259000    
 H    4.420500     -0.9057000      0.3102000    
 H    3.280200      -1.127300       1.646300    
 H    3.095700      -2.013100      0.1075000    
 H    2.709800       2.274800     -0.1826000    
 H    4.198700       1.459800      0.1836000    
 H    2.997400       1.649700       1.467300    
 H   -1.019300     -0.1801000      -1.814900    
 H    3.457600      8.2500003E-02  -1.718300    
 H   -3.990100      0.7904000     -0.9155000    


%chk=000126863-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126863

0 1
O -1.976601 -0.274042 -1.468822
O 2.457955 0.089430 -1.477784
O -4.184265 0.671237 -0.242167
C 1.096930 0.016580 0.522910
C -1.888302 -0.228392 0.022845
C 0.430211 -1.327283 0.115526
C 0.235216 1.217017 0.040958
C -1.054938 -1.419605 0.540327
C -1.242669 1.100135 0.478220
C 2.571334 0.115474 0.011831
C -3.371006 -0.336513 0.437345
C 3.432753 -1.084578 0.471930
C 3.249073 1.438153 0.442540
H 1.145139 0.054648 1.634081
H 0.972846 -2.176701 0.569183
H 0.522544 -1.448796 -0.981192
H 0.321080 1.293367 -1.061855
H 0.638299 2.165549 0.440417
H -1.492804 -2.362084 0.159229
H -1.126563 -1.446395 1.647770
H -1.299783 1.150888 1.585119
H -1.835846 1.946195 0.085094
H -3.485730 -0.148659 1.518540
H -3.734527 -1.360598 0.203796
H 4.488702 -0.939673 0.172118
H 3.410798 -1.195893 1.572012
H 3.079043 -2.024491 0.017558
H 2.751706 2.308049 -0.016781
H 4.310748 1.449271 0.128157
H 3.225489 1.560363 1.541544
H -1.092824 -0.055823 -1.856721
H 3.369048 0.147777 -1.862857
H -3.906359 0.628292 -1.196870


