%chk=000087340.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087340

0 1
 Si -0.4695000       1.553800      0.6080000    
 Si  0.4602000      -1.475200      0.6512000    
 O  -1.0200000E-02  4.5299999E-02   1.167700    
 N   -5.576700      9.5299996E-02  7.1000000E-03
 N    5.591200     -0.1277000      1.3500000E-02
 N   -9.070000     -0.6883000      -1.028800    
 N    9.098100      0.5633000      -1.042400    
 C   -2.024900       1.402700     -0.4421000    
 C    2.015900      -1.381200     -0.4010000    
 C   -3.242400      0.7998000      0.2688000    
 C    3.244500     -0.7818000      0.2937000    
 C   0.8811000       2.319200     -0.4537000    
 C  -0.8379000       2.721700       2.035000    
 C   0.7984000      -2.609300       2.112800    
 C  -0.9045000      -2.250800     -0.3877000    
 C   -4.432100      0.6779000     -0.6836000    
 C    4.436000     -0.7075000     -0.6614000    
 C   -6.720500     -1.6899999E-02 -0.8868000    
 C    6.736700     -6.0600001E-02 -0.8828000    
 C   -7.918800     -0.5922000     -0.1379000    
 C    7.945600      0.5127000     -0.1495000    
 H   -1.782700      0.7982000      -1.323900    
 H   -2.283500       2.402500     -0.8115000    
 H    1.784800     -0.7950000      -1.298100    
 H    2.256700      -2.394500     -0.7444000    
 H   -3.522600       1.427400       1.125000    
 H   -2.992400     -0.1889000      0.6729000    
 H    3.513100      -1.389800       1.167600    
 H    3.011300      0.2229000      0.6686000    
 H    1.804700       2.432600      0.1210000    
 H   0.5750000       3.307800     -0.8085000    
 H    1.091300       1.693600      -1.325800    
 H   -1.178300       3.691900       1.661400    
 H   5.9599999E-02   2.881300       2.639700    
 H   -1.617200       2.308400       2.681800    
 H    1.578900      -2.190200       2.754500    
 H  -0.1064000      -2.738500       2.714100    
 H    1.126700      -3.594500       1.768700    
 H   -1.826200      -2.344000      0.1936000    
 H  -0.6084000      -3.250000     -0.7207000    
 H   -1.112200      -1.644100      -1.273500    
 H   -4.149400      5.2900001E-02  -1.539600    
 H   -4.689800       1.673800      -1.063700    
 H    4.164600     -0.1011000      -1.534100    
 H    4.675200      -1.718100      -1.014200    
 H   -5.329800     -0.8246000      0.3711000    
 H    5.361400      0.8061000      0.3525000    
 H   -6.982100      0.9727000      -1.282300    
 H   -6.473500     -0.6633000      -1.738600    
 H    6.980000      -1.065300      -1.251200    
 H    6.501400      0.5669000      -1.751800    
 H   -7.684600      -1.590800      0.2477000    
 H   -8.177300      4.3000001E-02  0.7172000    
 H    7.729800       1.525500      0.2088000    
 H    8.192600     -0.1037000      0.7226000    
 H   -9.875700      -1.026500     -0.5041000    
 H   -9.319700      0.2396000      -1.368700    
 H    9.909900      0.9007000     -0.5270000    
 H    9.330600     -0.3779000      -1.357000    


%chk=000087340-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000087340

0 1
Si -0.538845 1.623686 1.062305
Si 0.535072 -1.597408 1.110149
O -0.007905 0.008588 0.912288
N -5.471883 0.138098 -0.560670
N 5.468643 -0.153254 -0.551609
N -8.917807 -0.600770 -1.943045
N 8.914648 0.547562 -1.953401
C -2.021016 1.858488 -0.129149
C 2.016612 -1.859438 -0.076792
C -3.217812 0.918670 0.159645
C 3.214877 -0.914960 0.189694
C 0.902019 2.774000 0.568563
C -1.058588 1.935618 2.873913
C 1.060780 -1.850877 2.929148
C -0.899864 -2.770960 0.655808
C -4.358043 1.062018 -0.869309
C 4.351844 -1.080229 -0.839548
C -6.621547 0.216358 -1.488511
C 6.616304 -0.252637 -1.479900
C -7.771667 -0.696048 -1.016290
C 7.770454 0.664363 -1.026756
H -1.656163 1.692491 -1.164175
H -2.350113 2.917969 -0.081783
H 1.650963 -1.716438 -1.114962
H 2.344675 -2.917936 -0.005963
H -3.634631 1.113488 1.166909
H -2.861270 -0.133051 0.160988
H 3.634416 -1.090174 1.199422
H 2.859668 0.137033 0.170993
H 1.767101 2.631585 1.241937
H 0.601302 3.837230 0.619417
H 1.232233 2.560643 -0.464521
H -1.401575 2.977735 3.016454
H -0.209431 1.759830 3.559532
H -1.883027 1.262698 3.172069
H 1.884839 -1.167520 3.203703
H 0.213220 -1.654989 3.611274
H 1.406065 -2.887414 3.103289
H -1.770600 -2.598554 1.314732
H -0.599006 -3.830463 0.757984
H -1.221568 -2.605668 -0.388689
H -3.939172 0.913008 -1.898632
H -4.753682 2.097459 -0.837997
H 3.930284 -0.949967 -1.870301
H 4.745334 -2.115766 -0.789637
H -5.129026 -0.830762 -0.476665
H 5.128666 0.818001 -0.485555
H -6.974349 1.268610 -1.500514
H -6.371673 -0.050377 -2.543607
H 6.965372 -1.306174 -1.472919
H 6.365520 -0.004727 -2.539350
H -7.420691 -1.747630 -1.019923
H -8.004312 -0.435872 0.042538
H 7.423193 1.716944 -1.049635
H 8.003946 0.423345 0.036402
H -9.607092 -1.351656 -1.850134
H -9.359450 0.323666 -1.964530
H 9.606236 1.298151 -1.876749
H 9.353523 -0.378416 -1.957734


