%chk=000005847.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005847

0 1
 Si  -2.631600      0.5833000      0.3605000    
 O   0.3524000       2.346300     -0.3617000    
 O   0.9419000      -1.782900       1.774600    
 O    4.406800      0.2347000     -0.4363000    
 N    2.333200       1.221100     -0.5251000    
 N    2.638800     -0.8124000      0.5925000    
 C   0.3236000     -3.8600001E-02  0.1738000    
 C  -0.8979000      0.2600000       1.089800    
 C   -3.219800      -1.080500     -0.3333000    
 C   1.0800000E-02 -0.7867000      -1.159500    
 C   -2.382200      -1.687600      -1.456700    
 C  -0.9288000      -1.999900      -1.077900    
 C   -3.780500       1.088000       1.763100    
 C   -2.657500       1.896900     -0.9585000    
 C   0.9792000       1.295000     -0.2363000    
 C    1.304900     -0.9433000      0.9503000    
 C    3.206600      0.2067000     -0.1593000    
 H   -1.069800     -0.5746000       1.780200    
 H  -0.6635000       1.115900       1.737000    
 H   -4.246400     -0.9461000     -0.6942000    
 H   -3.272400      -1.791400      0.5000000    
 H   0.9587000      -1.153500      -1.579700    
 H  -0.3584000     -8.2500003E-02  -1.916000    
 H   -2.411200      -1.046800      -2.346800    
 H   -2.862800      -2.630900      -1.747700    
 H  -0.8748000      -2.497100     -0.1038000    
 H  -0.5670000      -2.733700      -1.810700    
 H   -3.447700       2.028400       2.211900    
 H   -4.801000       1.224300       1.393400    
 H   -3.795900      0.3206000       2.542500    
 H   -2.340300       2.863200     -0.5553000    
 H   -2.001000       1.644400      -1.795200    
 H   -3.669300       2.020000      -1.357300    
 H    2.752600       2.043200     -0.9505000    
 H    3.281800      -1.495600      0.9832000    


%chk=000005847-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005847

0 1
Si -2.650461 0.574501 0.316413
O 0.449763 2.409984 -0.364503
O 0.882896 -1.909564 1.670630
O 4.521432 0.181790 -0.314116
N 2.432359 1.229756 -0.421681
N 2.647273 -0.894354 0.582725
C 0.332432 0.009125 0.207887
C -0.901826 0.308427 1.102810
C -3.243422 -1.140602 -0.331286
C -0.037237 -0.677857 -1.185524
C -2.390280 -1.789707 -1.451696
C -0.889109 -1.979176 -1.105481
C -3.774954 1.106516 1.774038
C -2.738527 1.905562 -1.057039
C 1.043818 1.317559 -0.183023
C 1.278553 -0.988637 0.911430
C 3.287915 0.167271 -0.079890
H -1.027498 -0.552131 1.789121
H -0.677941 1.187251 1.738339
H -4.290889 -1.036436 -0.682195
H -3.277502 -1.824177 0.543160
H 0.908127 -0.883104 -1.725302
H -0.572886 0.088217 -1.777804
H -2.472105 -1.192013 -2.383278
H -2.816673 -2.785042 -1.691420
H -0.793998 -2.445946 -0.106151
H -0.460044 -2.706473 -1.821801
H -3.505979 2.117253 2.133003
H -4.836398 1.129746 1.464943
H -3.685158 0.407573 2.626222
H -2.078634 2.756086 -0.814491
H -2.428653 1.514860 -2.043501
H -3.776519 2.275749 -1.154328
H 2.890733 2.060811 -0.809823
H 3.262894 -1.634917 0.934613


