%chk=000296298.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296298

0 1
N 0.050240 -0.399067 -0.815776
N 3.667676 0.088196 0.128304
N -3.469401 0.126512 0.428424
C 1.320949 -0.623267 -0.052807
C -1.153096 -0.610290 0.052669
C 2.423948 0.250365 -0.691748
C -2.295701 0.278317 -0.489971
C 4.489708 1.343336 0.145508
C 4.473106 -1.088394 -0.342197
C -4.312382 -1.054461 0.049314
C -4.254323 1.388308 0.551630
C -0.006140 -1.269440 -2.027699
C 3.814326 2.396939 1.025035
C 5.430545 -1.541670 0.761643
C -5.204355 -1.465992 1.222144
C -4.902104 1.914207 -0.733236
H 1.188438 -0.305811 1.005914
H 1.633762 -1.686873 -0.017274
H -1.474760 -1.670263 0.112601
H -0.926497 -0.298022 1.096676
H 2.088294 1.311660 -0.676902
H 2.563326 -0.009306 -1.760933
H -2.525703 0.023094 -1.544516
H -1.949848 1.335456 -0.499834
H 5.487821 1.098342 0.574059
H 4.672164 1.752344 -0.871484
H 3.771356 -1.920117 -0.576079
H 5.037824 -0.878900 -1.276144
H -4.933475 -0.867240 -0.853478
H -3.630960 -1.897974 -0.202224
H -5.037750 1.218304 1.323986
H -3.570327 2.159706 0.972337
H -0.917349 -1.031998 -2.599211
H -0.001105 -2.349689 -1.820149
H 0.853605 -1.038499 -2.676406
H 2.862861 2.737072 0.598791
H 3.585866 1.986366 2.018070
H 4.457833 3.271307 1.158472
H 6.220927 -0.805525 0.946630
H 4.893634 -1.675347 1.711035
H 5.907012 -2.492396 0.504826
H -4.620273 -1.543073 2.149345
H -6.002029 -0.737740 1.404732
H -5.672507 -2.437694 1.037548
H -4.156382 2.142872 -1.501947
H -5.601638 1.187337 -1.160445
H -5.464014 2.834107 -0.539936


%chk=000296298-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296298

0 1
N 0.049494 -0.309014 -0.685644
N 3.774349 0.125573 0.078747
N -3.597197 0.093881 0.384146
C 1.327953 -0.419997 0.061681
C -1.159535 -0.444503 0.167811
C 2.490836 0.309561 -0.649444
C -2.359912 0.356535 -0.393124
C 4.669287 1.310319 -0.012936
C 4.456955 -1.144126 -0.293028
C -4.317269 -1.120494 -0.073141
C -4.446262 1.291453 0.599459
C 0.003319 -1.209473 -1.857747
C 4.212544 2.475938 0.885150
C 5.399590 -1.668403 0.807537
C -5.351589 -1.639540 0.943589
C -5.131690 1.889816 -0.661524
H 1.202760 0.049770 1.053031
H 1.610810 -1.488274 0.246721
H -1.454282 -1.515218 0.306493
H -0.935249 -0.049033 1.174115
H 2.239150 1.383676 -0.683276
H 2.574681 -0.027239 -1.711679
H -2.491914 0.134846 -1.479664
H -2.108923 1.430679 -0.326280
H 5.679090 0.996247 0.308988
H 4.771228 1.664533 -1.070946
H 3.674392 -1.904102 -0.475545
H 5.021356 -1.035999 -1.255382
H -4.816509 -0.965695 -1.064196
H -3.557135 -1.908557 -0.232909
H -5.219137 1.039115 1.349172
H -3.807780 2.066544 1.065275
H -0.938852 -1.062894 -2.413330
H 0.070427 -2.290482 -1.569629
H 0.833935 -0.987432 -2.549535
H 3.209375 2.844110 0.602996
H 4.169748 2.147467 1.938217
H 4.916175 3.325966 0.805074
H 6.217390 -0.957389 1.023784
H 4.835487 -1.830711 1.742434
H 5.861255 -2.625167 0.498654
H -4.874021 -1.791228 1.927813
H -6.195804 -0.938647 1.074146
H -5.771180 -2.603901 0.601971
H -4.384027 2.177865 -1.423405
H -5.834221 1.173205 -1.125181
H -5.705994 2.795516 -0.390163


