%chk=000078839.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078839

0 1
 Si   1.441900      -1.584000      0.1697000    
 Si   1.546600       1.396700      0.2225000    
 Si  -1.546200      -1.470700      0.1723000    
 Si  -1.425000       1.509400      0.2227000    
 N    1.653200     -0.1143000       1.007500    
 N  -5.8400001E-02  -1.675600     -0.6322000    
 N   6.5800004E-02   1.587500     -0.6048000    
 N   -1.644900      1.1400000E-02   1.009200    
 C    1.636600      -2.987700       1.408400    
 C    1.779100       2.715000       1.483400    
 C   -1.843700      -2.854400       1.413100    
 C   -1.557100       2.842500       1.482700    
 C    2.772700      -1.819600      -1.079100    
 C    2.935900       1.609200      -1.030200    
 C   -2.893300      -1.606400      -1.073800    
 C   -2.794800       1.824600      -1.029800    
 C    4.083900      -1.824600     -0.8183000    
 C    4.150400       2.098400     -0.7603000    
 C   -4.200700      -1.512300     -0.8105000    
 C   -4.102200       1.854900     -0.7525000    
 H    1.103600     -0.1105000       1.866200    
 H  -3.8199998E-02  -1.122300      -1.488400    
 H   9.7199999E-02   2.407100      -1.210200    
 H   -2.468000      3.5200000E-02   1.610100    
 H    1.335100      -3.942400      0.9668000    
 H    2.679500      -3.077600       1.728700    
 H    1.036500      -2.814300       2.305200    
 H    1.154900       2.560100       2.367100    
 H    2.808700       2.744900       1.854500    
 H    1.552400       3.707900       1.081900    
 H   -1.613500      -3.829500      0.9731000    
 H   -1.232100      -2.723900       2.309400    
 H   -2.890300      -2.866700       1.733700    
 H   -2.601400       3.020300       1.761700    
 H   -1.035700       2.592500       2.410600    
 H   -1.159300       3.794000       1.115700    
 H    2.440300      -1.963300      -2.102500    
 H    2.686800       1.309800      -2.043100    
 H   -2.574700      -1.773800      -2.097900    
 H   -2.455300       1.987900      -2.047300    
 H    4.797800      -1.970100      -1.622400    
 H    4.479800      -1.685000      0.1822000    
 H    4.884700       2.188100      -1.554500    
 H    4.454600       2.410500      0.2319000    
 H   -4.925100      -1.603600      -1.613200    
 H   -4.583200      -1.346100      0.1913000    
 H   -4.822100       2.042800      -1.542200    
 H   -4.486500       1.697100      0.2497000    


%chk=000078839-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000078839

0 1
Si 1.518028 -1.539443 0.918551
Si 1.411649 1.490809 -0.188031
Si -1.449898 -1.782867 -0.309272
Si -1.658597 1.261785 0.764268
N 1.833096 0.220222 0.988127
N 0.333372 -1.872304 -0.362698
N -0.358437 1.572486 -0.399634
N -2.011965 -0.498156 0.782425
C 0.880270 -2.129977 2.613378
C 2.141840 3.107622 0.516187
C -2.212281 -3.398846 0.370079
C -1.186346 1.815244 2.523426
C 3.111214 -2.470301 0.453822
C 2.102269 1.157185 -1.928583
C -1.986191 -1.524006 -2.118146
C -3.196335 2.208658 0.163309
C 4.236312 -1.864334 -0.013847
C 2.979694 1.960393 -2.589875
C -3.057767 -0.779157 -2.502108
C -3.924095 3.083604 0.909570
H 2.388228 0.545662 1.788429
H 0.740169 -2.103207 -1.276006
H -0.665236 1.798511 -1.352820
H -2.664729 -0.813200 1.510073
H 0.738551 -3.226080 2.621102
H 1.597232 -1.874410 3.415468
H -0.085370 -1.646382 2.844696
H 1.724865 3.308553 1.520029
H 3.243342 3.060420 0.600571
H 1.880419 3.965687 -0.128813
H -1.907375 -4.257390 -0.255360
H -1.864999 -3.592762 1.401665
H -3.316990 -3.353933 0.369592
H -1.988132 1.581235 3.248276
H -0.270711 1.286699 2.842251
H -0.996497 2.903163 2.559150
H 3.115451 -3.568126 0.562736
H 1.762500 0.238732 -2.435769
H -1.405694 -2.031425 -2.908522
H -3.533169 2.019950 -0.870776
H 5.140369 -2.426618 -0.286923
H 4.277762 -0.774027 -0.142644
H 3.352894 1.721222 -3.595569
H 3.359594 2.891514 -2.148273
H -3.353576 -0.668359 -3.554569
H -3.679754 -0.255719 -1.763172
H -4.813746 3.594798 0.515853
H -3.654930 3.325976 1.946482


