%chk=000187788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187788

0 1
Si -1.824027 -0.609014 -0.466237
N 2.084005 0.958414 -0.082162
C -0.069863 -0.027277 -0.821223
C -2.799134 0.693959 0.488796
C -1.820758 -2.150692 0.622897
C 0.783094 0.358337 0.389608
C -2.650238 -0.969512 -2.105348
C -2.838876 2.085758 -0.147680
C -1.059753 -3.356647 0.066791
C 2.996427 -0.096447 -0.634389
C 2.750229 1.701125 1.040017
C 4.285190 0.549454 -1.170263
C 4.035865 2.376363 0.532472
C 4.999103 1.346974 -0.071656
C -3.671738 3.062665 0.702128
C -1.130593 -4.553318 1.032948
C -3.713542 4.457533 0.081481
C -0.372677 -5.763749 0.491694
H 0.435167 -0.822381 -1.417192
H -0.141626 0.847731 -1.513911
H -3.834421 0.306111 0.623170
H -2.368823 0.757925 1.513593
H -1.402621 -1.861107 1.613432
H -2.882683 -2.425745 0.815230
H 0.255619 1.134197 0.991202
H 0.940952 -0.516956 1.058100
H -2.697941 -0.067344 -2.732953
H -2.106862 -1.742163 -2.668011
H -3.679898 -1.326975 -1.956925
H -3.265338 2.036576 -1.169846
H -1.811919 2.488890 -0.266800
H 0.002781 -3.096753 -0.114783
H -1.471831 -3.658059 -0.917438
H 3.247991 -0.879662 0.112605
H 2.460295 -0.602536 -1.467256
H 2.984503 1.049192 1.908525
H 2.041987 2.480167 1.396466
H 4.951375 -0.230290 -1.579549
H 4.032013 1.223607 -2.013045
H 3.771663 3.131697 -0.234865
H 4.521061 2.923796 1.359748
H 5.889456 1.854436 -0.485467
H 5.370206 0.664070 0.715244
H -4.701438 2.673802 0.819375
H -3.252580 3.120704 1.724965
H -0.719028 -4.263928 2.018923
H -2.188113 -4.824862 1.215761
H -4.161028 4.440216 -0.918622
H -4.304065 5.147009 0.694312
H -2.708690 4.883825 -0.018081
H 0.688018 -5.538023 0.334765
H -0.429405 -6.609510 1.185629
H -0.781487 -6.098680 -0.468274


%chk=000187788-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187788

0 1
Si -1.879824 -0.623041 -0.381181
N 2.084371 0.936980 -0.026745
C -0.097374 -0.064248 -0.866432
C -2.782694 0.791066 0.567912
C -1.794699 -2.184407 0.748351
C 0.792610 0.295069 0.342118
C -2.841496 -1.037517 -1.988825
C -2.868424 2.137727 -0.196322
C -1.054059 -3.394961 0.124274
C 2.985875 0.032400 -0.783821
C 2.767217 1.489986 1.172730
C 4.267447 0.766196 -1.230923
C 4.038243 2.273057 0.787241
C 5.005457 1.376742 -0.018163
C -3.627538 3.236633 0.585757
C -1.019592 -4.635371 1.049433
C -3.713796 4.573324 -0.182761
C -0.292261 -5.840979 0.415066
H 0.359776 -0.877527 -1.464485
H -0.162807 0.818267 -1.533944
H -3.807655 0.440558 0.814076
H -2.277604 0.950895 1.544079
H -1.306804 -1.906841 1.706653
H -2.832399 -2.480963 1.010997
H 0.255691 1.018825 0.987672
H 0.962835 -0.624325 0.965599
H -2.920596 -0.151079 -2.645321
H -2.337096 -1.835861 -2.564227
H -3.867749 -1.381489 -1.759979
H -3.371605 1.984540 -1.173979
H -1.846901 2.504519 -0.429001
H -0.011441 -3.107198 -0.127646
H -1.537145 -3.678153 -0.834162
H 3.270776 -0.860249 -0.160956
H 2.446063 -0.344294 -1.670259
H 3.047980 0.671817 1.891450
H 2.056127 2.156018 1.697962
H 4.924654 0.059251 -1.773623
H 3.985459 1.572092 -1.935946
H 3.745641 3.146879 0.173300
H 4.527822 2.654386 1.704325
H 5.888754 1.955000 -0.349766
H 5.378288 0.559645 0.634292
H -4.649024 2.872487 0.819159
H -3.124926 3.397848 1.561444
H -0.526339 -4.360540 2.004185
H -2.059876 -4.920263 1.308259
H -4.239403 4.442236 -1.147694
H -4.258923 5.340847 0.397180
H -2.704334 4.969439 -0.402960
H 0.758331 -5.589102 0.175264
H -0.283504 -6.713455 1.094247
H -0.785526 -6.149961 -0.526005


