%chk=000273479.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273479

0 1
N 0.855276 1.816941 0.487415
N -0.457653 1.565094 0.343204
N -0.825881 0.348758 0.383674
N 0.741376 0.040418 -2.752388
N -0.727464 -2.933838 -0.766778
C 1.892705 0.788893 0.512838
C 1.272399 3.189029 0.044662
C 2.107090 -0.107016 -0.558316
C 2.680079 0.705918 1.670303
C 1.593408 3.262953 -1.441897
C 3.096240 -1.098795 -0.440824
C 3.671305 -0.274010 1.763474
C 3.875830 -1.176830 0.714630
C -2.227272 0.051907 0.386976
C -2.560908 -1.266692 -0.017204
C -3.242298 0.932596 0.802258
C -3.903846 -1.675622 -0.004973
C -4.570516 0.506361 0.810758
C -4.902941 -0.792284 0.407807
C 1.342956 -0.029526 -1.767312
C -1.544955 -2.186028 -0.434562
H 0.454886 3.903323 0.302782
H 2.159970 3.465932 0.658427
H 2.504159 1.392197 2.499386
H 2.434205 2.615482 -1.721444
H 0.736867 2.959522 -2.062725
H 1.857668 4.285764 -1.737722
H 3.244108 -1.812098 -1.255243
H 4.281003 -0.340965 2.665458
H 4.639871 -1.949730 0.801192
H -2.986711 1.945986 1.113788
H -4.161968 -2.688308 -0.320314
H -5.355375 1.191937 1.132702
H -5.943115 -1.115571 0.415470


%chk=000273479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273479

0 1
N 0.842306 1.783669 0.301887
N -0.506011 1.524178 0.304899
N -0.798583 0.245006 0.339442
N 0.621039 0.136858 -2.983041
N -0.709110 -3.293490 0.543147
C 1.859893 0.755660 0.324762
C 1.209337 3.217610 0.256531
C 2.037722 -0.132276 -0.779187
C 2.684968 0.631413 1.462260
C 1.784276 3.643652 -1.109321
C 3.030368 -1.144528 -0.708468
C 3.681908 -0.367681 1.516502
C 3.848013 -1.261207 0.433908
C -2.197066 -0.026956 0.344442
C -2.550323 -1.411978 0.420595
C -3.231265 0.946781 0.272393
C -3.918223 -1.797843 0.427391
C -4.580923 0.550551 0.280478
C -4.930632 -0.821700 0.358541
C 1.248541 0.009126 -1.973443
C -1.525844 -2.421190 0.487165
H 0.284800 3.773468 0.484518
H 1.941436 3.423705 1.060427
H 2.524674 1.302108 2.312880
H 2.712138 3.093339 -1.346085
H 1.055267 3.455525 -1.915847
H 2.022471 4.722605 -1.093977
H 3.148181 -1.833329 -1.550229
H 4.311754 -0.459368 2.407398
H 4.606141 -2.049107 0.481216
H -2.954160 2.002595 0.205824
H -4.170546 -2.861158 0.484304
H -5.369221 1.309315 0.222451
H -5.982831 -1.123654 0.361738


