%chk=000076482.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076482

0 1
 Si  -2.556200      0.2714000     -0.1439000    
 O   -3.779800      0.5127000      0.9794000    
 O   -2.726300      -1.244200     -0.8450000    
 N    2.757500      1.5799999E-02 -0.2777000    
 N    6.458000     -5.2299999E-02  0.2010000    
 C  -0.8808000      0.4226000      0.7045000    
 C   0.3350000      0.1698000     -0.1929000    
 C    1.637600      0.2689000      0.5966000    
 C   -2.616800       1.596500      -1.481700    
 C    4.026500      9.0000004E-02  0.4433000    
 C    5.190400     -0.1439000     -0.5151000    
 C   -5.134700      0.4946000      0.5535000    
 C   -2.710500      -2.401900     -2.2000000E-02
 H  -0.8638000     -0.2826000       1.544100    
 H  -0.8084000       1.427300       1.137900    
 H   0.2589000     -0.8254000     -0.6512000    
 H   0.3469000      0.8967000      -1.015800    
 H    1.619300     -0.4637000       1.412400    
 H    1.715400       1.267100       1.044700    
 H   -1.819500       1.443100      -2.214500    
 H   -3.574300       1.566300      -2.009800    
 H   -2.496300       2.590800      -1.042000    
 H    2.759800      0.6863000      -1.045900    
 H    4.133600       1.075100      0.9152000    
 H    4.046700     -0.6674000       1.236900    
 H    5.109200      -1.132100     -0.9822000    
 H    5.182700      0.6045000      -1.315600    
 H   -5.769400      0.6216000       1.435900    
 H   -5.394000     -0.4614000      8.5500002E-02
 H   -5.343100       1.321700     -0.1336000    
 H   -1.743700      -2.516700      0.4801000    
 H   -2.863300      -3.275700     -0.6629000    
 H   -3.520100      -2.378000      0.7156000    
 H    6.493200     -0.7645000      0.9293000    
 H    7.223300     -0.2604000     -0.4390000    


%chk=000076482-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000076482

0 1
Si -2.574128 0.343053 -0.216363
O -3.765623 0.578794 1.028925
O -2.779621 -1.220582 -0.951422
N 2.814069 0.061570 -0.209629
N 6.565371 -0.181975 0.235660
C -0.925013 0.470496 0.719092
C 0.326875 0.204078 -0.154128
C 1.639326 0.337463 0.645031
C -2.807422 1.530725 -1.671383
C 4.120976 0.154233 0.477736
C 5.266400 -0.277248 -0.460408
C -5.206881 0.609991 0.803072
C -2.627623 -2.493178 -0.255466
H -0.958396 -0.243309 1.567052
H -0.869049 1.478744 1.176447
H 0.288011 -0.809003 -0.598677
H 0.351885 0.917201 -1.006053
H 1.639194 -0.399456 1.473727
H 1.672705 1.351287 1.122671
H -2.043568 1.345752 -2.447172
H -3.796478 1.382146 -2.139898
H -2.729223 2.583635 -1.347121
H 2.798620 0.648340 -1.057290
H 4.354629 1.172193 0.872309
H 4.090824 -0.527780 1.352739
H 5.022578 -1.289614 -0.858438
H 5.297850 0.410793 -1.329165
H -5.687217 0.689938 1.792659
H -5.562462 -0.312333 0.301307
H -5.503843 1.485705 0.190383
H -1.602722 -2.618254 0.151400
H -2.814242 -3.289559 -0.995362
H -3.353842 -2.594372 0.575801
H 6.668443 -0.836368 1.017476
H 7.382597 -0.190505 -0.380410


