%chk=000232923.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232923

0 1
O -6.492113 -0.625408 -0.422687
N 5.493495 0.215806 -0.030573
N -0.916386 -0.458473 -0.597794
C -5.295421 1.603405 0.754549
C -4.479884 0.490739 0.130829
C -3.083922 0.513240 0.110438
C -5.112301 -0.620935 -0.461982
C -5.045314 2.929022 0.024019
C -4.987772 1.724548 2.252959
C -2.339745 -0.524777 -0.481838
C 4.105638 0.127002 0.072063
C -3.000595 -1.626921 -1.082176
C 6.351405 0.500788 1.146795
C 6.195946 0.049786 -1.327786
C -4.399750 -1.667870 -1.059051
C 3.460770 0.253571 1.333714
C 3.303727 -0.094440 -1.080178
C 1.285835 -0.057992 0.282887
C 2.079302 0.163017 1.424163
C 1.923792 -0.185680 -0.966005
C 6.761722 -0.783417 1.868905
C 6.312883 1.374985 -2.081905
C -2.224976 -2.735499 -1.709259
C -0.174957 -0.147828 0.423390
H -6.384694 1.347427 0.644576
H -2.561653 1.364562 0.548605
H -5.250910 2.829699 -1.048333
H -5.690018 3.722719 0.414668
H -4.008316 3.264901 0.126562
H -5.635638 2.468267 2.728306
H -3.951573 2.025931 2.435486
H -5.147836 0.768321 2.764112
H 5.811890 1.179671 1.848334
H 7.254000 1.059135 0.810388
H 5.654644 -0.700002 -1.951834
H 7.206451 -0.377505 -1.138789
H -4.926062 -2.505314 -1.505785
H 4.044240 0.420247 2.234264
H 3.763138 -0.192904 -2.059553
H 1.604358 0.262977 2.401392
H 1.314473 -0.357450 -1.858880
H 5.884867 -1.357666 2.197095
H 7.365905 -0.563424 2.755422
H 7.347536 -1.446124 1.221697
H 6.800932 1.236264 -3.052547
H 6.892479 2.115801 -1.519696
H 5.325832 1.820269 -2.267113
H -2.842234 -3.399443 -2.323746
H -1.728085 -3.348781 -0.942725
H -1.420024 -2.336323 -2.351075
H -0.553240 0.059147 1.439884
H -6.866639 -1.423371 -0.866192


%chk=000232923-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232923

0 1
O -6.606839 -0.527691 -0.507656
N 5.534592 0.235783 -0.002309
N -0.947621 -0.590779 -0.663625
C -5.256753 1.530053 0.959476
C -4.501032 0.442290 0.192373
C -3.090619 0.404752 0.151835
C -5.192196 -0.559267 -0.537657
C -5.027549 2.926513 0.320578
C -4.875608 1.542262 2.463273
C -2.363150 -0.579489 -0.576766
C 4.142917 0.124187 0.079621
C -3.083840 -1.565372 -1.325584
C 6.337631 0.763372 1.119426
C 6.276632 -0.159330 -1.216933
C -4.493430 -1.538697 -1.283915
C 3.438894 0.402724 1.297897
C 3.356072 -0.272408 -1.057050
C 1.266211 -0.098538 0.237256
C 2.041205 0.295311 1.363286
C 1.963438 -0.380556 -0.973301
C 6.746772 -0.314495 2.151298
C 6.386531 0.968260 -2.270817
C -2.341259 -2.621054 -2.118259
C -0.189322 -0.200480 0.338094
H -6.333912 1.297470 0.883869
H -2.530447 1.191204 0.672610
H -5.337949 2.933118 -0.739697
H -5.609874 3.699021 0.857428
H -3.960227 3.214529 0.362826
H -5.474568 2.296755 3.007110
H -3.807797 1.794898 2.605781
H -5.056236 0.556281 2.928092
H 5.782546 1.579185 1.618670
H 7.247018 1.227898 0.693194
H 5.806563 -1.055174 -1.662595
H 7.291785 -0.469980 -0.904950
H -5.055623 -2.296785 -1.847538
H 3.986105 0.688598 2.200360
H 3.839985 -0.479884 -2.015701
H 1.534077 0.513067 2.312625
H 1.373512 -0.677398 -1.847028
H 5.858829 -0.791032 2.601582
H 7.350748 0.133845 2.962166
H 7.349552 -1.107739 1.673019
H 6.960269 0.622272 -3.150757
H 6.902464 1.850202 -1.849751
H 5.388069 1.292128 -2.611870
H -3.019613 -3.165898 -2.798075
H -1.858246 -3.358873 -1.449796
H -1.527605 -2.158108 -2.703617
H -0.619679 0.055251 1.331633
H -6.976218 -1.258502 -1.062126


