%chk=000157882.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157882

0 1
 Si  -5.331000     -6.6999998E-03 -0.1016000    
 Si   5.338300      1.7000000E-03 -0.1055000    
 O   -5.456200       1.344300      -1.093200    
 O   -5.417600      -1.385200      -1.058100    
 O   -6.626400     -5.0000002E-04  0.9695000    
 O    5.445800      -1.352100      -1.090400    
 O    5.427800       1.377500      -1.060100    
 O    6.626400     -1.2700000E-02  0.9698000    
 N  -8.9999998E-04  1.7700000E-02  5.7399999E-02
 C   -2.450800      3.7599999E-02  4.1000000E-03
 C    2.450400     -2.0900000E-02  4.9999999E-03
 C   -1.200000      2.7700000E-02  0.8833000    
 C    1.200000      9.9999997E-05  0.8844000    
 C   -3.725400      3.9099999E-02  0.8565000    
 C    3.725300     -3.0500000E-02  0.8572000    
 C   -5.445900       2.639600     -0.5107000    
 C   -5.363400      -2.665100     -0.4447000    
 C   -7.954500     -3.1700000E-02  0.4660000    
 C    5.422800      -2.646200     -0.5056000    
 C    5.380600       2.658900     -0.4493000    
 C    7.954700      7.4999998E-03  0.4661000    
 H   -2.438400      0.9213000     -0.6478000    
 H   -2.441600     -0.8417000     -0.6538000    
 H    2.429700     -0.9052000     -0.6457000    
 H    2.450200      0.8576000     -0.6539000    
 H   -1.206600      0.9114000       1.533100    
 H   -1.220300     -0.8618000       1.524700    
 H    1.199700     -0.8884000       1.527200    
 H    1.226000      0.8849000       1.532200    
 H   -3.706100     -0.8249000       1.531500    
 H   -3.727400      0.9288000       1.497500    
 H    3.715300      0.8354000       1.529800    
 H    3.723500     -0.9196000       1.498800    
 H   8.9999996E-03  0.8377000     -0.5484000    
 H   -5.587100       3.372100      -1.311500    
 H   -4.484400       2.848500     -2.9400000E-02
 H   -6.264000       2.763100      0.2073000    
 H   -5.480900      -3.421300      -1.227000    
 H   -6.176200      -2.797600      0.2777000    
 H   -4.395000      -2.829600      4.0100001E-02
 H   -8.641000     -2.0800000E-02   1.318100    
 H   -8.140100     -0.9469000     -0.1065000    
 H   -8.166000      0.8489000     -0.1503000    
 H    5.555800      -3.381600      -1.305100    
 H    4.459800      -2.844500     -2.3100000E-02
 H    6.240200      -2.776800      0.2120000    
 H    5.500800       3.412900      -1.233300    
 H    6.194900       2.788900      0.2719000    
 H    4.413700       2.829200      3.6400001E-02
 H    8.641000     -7.0000002E-03   1.318400    
 H    8.147900      0.9205000     -0.1078000    
 H    8.160200     -0.8759000     -0.1483000    


%chk=000157882-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157882

0 1
Si -5.372531 -0.023715 -0.069772
Si 5.371978 -0.004506 -0.067585
O -5.552335 1.302414 -1.152153
O -5.393742 -1.346637 -1.166337
O -6.675432 -0.094757 1.058640
O 5.399151 -1.326485 -1.165217
O 5.546107 1.323087 -1.148988
O 6.674836 -0.071241 1.061150
N -0.000502 0.098113 0.284637
C -2.490330 0.058725 0.171126
C 2.489503 0.066815 0.172281
C -1.246179 0.126365 1.079481
C 1.244740 0.130276 1.080069
C -3.806536 0.062670 0.989175
C 3.805328 0.074319 0.990957
C -5.588641 2.705217 -0.758327
C -5.198454 -2.746873 -0.812545
C -8.096381 -0.165114 0.722000
C 5.213637 -2.728147 -0.811867
C 5.575014 2.725999 -0.754976
C 8.096186 -0.135961 0.725106
H -2.481543 0.917283 -0.532473
H -2.420434 -0.850828 -0.455217
H 2.422676 -0.842652 -0.454514
H 2.478438 0.925685 -0.530910
H -1.323015 1.030605 1.739236
H -1.239241 -0.753067 1.755267
H 1.240411 -0.749250 1.755756
H 1.318403 1.034671 1.739965
H -3.821764 -0.794757 1.691153
H -3.865864 0.971876 1.620442
H 3.860978 0.982658 1.623809
H 3.823392 -0.784233 1.691491
H -0.001524 0.830690 -0.440348
H -5.670150 3.292441 -1.687503
H -4.664727 3.010193 -0.223989
H -6.461217 2.928580 -0.112182
H -5.204478 -3.315054 -1.756893
H -6.012532 -3.121789 -0.160401
H -4.227118 -2.914544 -0.302716
H -8.654055 -0.090276 1.669999
H -8.343218 -1.124551 0.227541
H -8.396666 0.664589 0.052503
H 5.225851 -3.296218 -1.756221
H 4.242465 -2.902953 -0.304147
H 6.029036 -3.097162 -0.157982
H 5.650527 3.313872 -1.684250
H 6.448037 2.954328 -0.111205
H 4.650800 3.025425 -0.218019
H 8.653145 -0.059395 1.673388
H 8.393582 0.695188 0.056121
H 8.346990 -1.094220 0.230345


