%chk=000104953.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104953

0 1
 O   -2.201300      -1.697900      3.3100002E-02
 O    2.597400      -1.204800     -0.1034000    
 O   -3.763700       2.251400     -0.9865000    
 O    4.862900     -0.9014000     -0.1635000    
 C   -1.277800      0.3604000      0.1405000    
 C   -1.029100      -1.003200      3.8699999E-02
 C   0.2429000      -1.558400     -4.4399999E-02
 C   -2.690700      0.4914000      0.1998000    
 C    1.128600      0.7411000      8.0899999E-02
 C    1.302700     -0.6430000     -1.9400001E-02
 C  -0.1826000       1.248500      0.1619000    
 C   -3.201700     -0.7838000      0.1310000    
 C    2.322800       1.600200      9.7000003E-02
 C   -3.461200       1.744900      0.3134000    
 C   0.4738000      -3.026700     -0.1517000    
 C   -4.569200      -1.324100      0.1434000    
 C    3.535300       1.034700      1.5900001E-02
 C    2.172300       3.089900      0.2035000    
 C    3.738400     -0.4190000     -9.0200000E-02
 H  -0.3730000       2.314700      0.2404000    
 H   -4.404100       1.582300      0.8462000    
 H   -2.895800       2.508800      0.8570000    
 H    1.005300      -3.261500      -1.079600    
 H    1.066000      -3.382000      0.6980000    
 H  -0.4655000      -3.588600     -0.1578000    
 H   -4.964400      -1.336200       1.163800    
 H   -5.234500     -0.7139000     -0.4753000    
 H   -4.597700      -2.347200     -0.2448000    
 H    4.436000       1.641200      2.5200000E-02
 H    1.664100       3.364300       1.134100    
 H    1.601200       3.485000     -0.6436000    
 H    3.142200       3.600100      0.2038000    
 H   -4.268800       3.072700     -0.8604000    


%chk=000104953-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000104953

0 1
O -2.222283 -1.783084 0.070893
O 2.606221 -1.203766 -0.050106
O -3.145260 2.633807 -0.805233
O 4.894684 -0.937236 -0.113787
C -1.299728 0.345023 0.133700
C -1.016010 -1.052958 0.067531
C 0.264206 -1.618705 0.004985
C -2.754476 0.468742 0.183533
C 1.097568 0.758356 0.060930
C 1.313096 -0.662621 0.008701
C -0.232207 1.258382 0.117151
C -3.272672 -0.812614 0.136130
C 2.272562 1.630323 0.038196
C -3.521624 1.746337 0.320988
C 0.523239 -3.105102 -0.064996
C -4.650201 -1.385533 0.148094
C 3.535893 1.073747 -0.020613
C 2.097325 3.132509 0.078454
C 3.789715 -0.360686 -0.064701
H -0.425934 2.333124 0.123998
H -4.612419 1.543706 0.316133
H -3.263096 2.238308 1.284509
H 1.061257 -3.366369 -0.993780
H 1.168408 -3.430812 0.770040
H -0.421996 -3.668986 -0.030176
H -4.822999 -2.001393 1.050217
H -5.405924 -0.583587 0.126661
H -4.810500 -2.036166 -0.730787
H 4.431059 1.701457 -0.037893
H 1.565522 3.446768 0.996125
H 1.497694 3.485495 -0.781376
H 3.071461 3.646799 0.052922
H -3.601779 3.506638 -0.689443


