%chk=000225502.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225502

0 1
S 4.788583 -2.069267 -0.707099
N -1.362845 -0.202026 0.506401
N -2.141973 1.819168 -0.255369
C 0.265977 1.763162 0.492294
C -1.071153 1.162290 0.227553
C -2.712268 -0.402230 0.157257
C 1.403365 0.814661 0.230376
C -3.188508 0.873652 -0.312050
C 1.635065 0.342814 -1.073765
C 2.240279 0.404193 1.275295
C -3.547963 -1.530274 0.205289
C -4.523481 1.012374 -0.734747
C 2.692748 -0.528579 -1.328020
C 3.301943 -0.473673 1.025813
C -4.856392 -1.359819 -0.218948
C 3.521288 -0.933862 -0.271622
C -5.337243 -0.107354 -0.681788
C 5.957034 -2.052783 0.667279
H 0.287746 2.149852 1.537886
H 0.384015 2.678728 -0.141997
H -0.720992 -0.901216 0.830861
H 0.984096 0.662751 -1.888866
H 2.072823 0.766604 2.288506
H -3.179896 -2.487388 0.559107
H -4.882678 1.977184 -1.087894
H 2.869581 -0.884276 -2.344771
H 3.938839 -0.785149 1.851868
H -5.543698 -2.205124 -0.200824
H -6.375956 -0.036640 -1.001598
H 6.310196 -1.041925 0.900725
H 6.827432 -2.650709 0.359018
H 5.539735 -2.506336 1.572732


%chk=000225502-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225502

0 1
S 5.011461 -1.967425 -0.830990
N -1.392794 -0.180385 0.475967
N -2.185134 1.833591 -0.247187
C 0.238046 1.781324 0.497668
C -1.111470 1.170078 0.216054
C -2.739452 -0.406472 0.154332
C 1.416149 0.856297 0.206645
C -3.224024 0.871966 -0.293892
C 1.641984 0.356921 -1.105005
C 2.318754 0.474905 1.226891
C -3.560236 -1.551616 0.202746
C -4.569521 1.011614 -0.702432
C 2.731910 -0.488339 -1.384123
C 3.418096 -0.375516 0.960409
C -4.901035 -1.389615 -0.209497
C 3.631094 -0.862385 -0.349276
C -5.397793 -0.129123 -0.654306
C 5.958709 -2.164090 0.776634
H 0.274397 2.104645 1.557086
H 0.292703 2.704027 -0.108143
H -0.709796 -0.869242 0.788180
H 0.957943 0.637284 -1.915217
H 2.170720 0.849532 2.247488
H -3.187882 -2.523828 0.542563
H -4.944575 1.981542 -1.042925
H 2.889372 -0.856222 -2.404365
H 4.093400 -0.643089 1.778797
H -5.576101 -2.252337 -0.186917
H -6.445438 -0.049211 -0.964356
H 6.333068 -1.190794 1.130327
H 6.810058 -2.817870 0.532535
H 5.333086 -2.647362 1.543212


