%chk=000191065.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191065

0 1
O -2.336440 2.917773 -0.632672
O -0.552583 4.055397 0.712518
N 2.686768 -1.556627 0.451641
N -3.379473 -0.842147 -0.551905
C 2.654276 -1.657730 -1.045769
C 3.433556 -2.711799 1.055035
C -4.036479 -0.405883 0.726089
C -4.381251 -1.451153 -1.491290
C 4.088070 -1.660631 -1.600269
C 4.879209 -2.726259 0.530723
C -4.690378 -1.612724 1.418003
C -5.036665 -2.675486 -0.830504
C 4.910808 -2.807316 -1.000352
C -5.707836 -2.294265 0.494748
C 1.294140 -1.499335 1.011154
C -2.700791 0.321625 -1.217146
C 0.614557 -0.191296 0.621412
C -1.486330 0.764157 -0.416396
C -0.593429 -0.278780 0.010721
C 1.364362 0.994845 0.961391
C 1.014928 2.300994 0.941040
C -1.333308 2.093032 -0.165982
C 2.035772 3.352823 1.379999
C -0.271885 2.866752 0.539655
C 2.466330 3.119413 2.832739
C 3.238480 3.357887 0.429624
H 2.107525 -0.769304 -1.432472
H 2.106964 -2.556115 -1.402901
H 2.948593 -3.690628 0.851348
H 3.441954 -2.573362 2.157836
H -4.789017 0.396444 0.567729
H -3.246527 0.019940 1.383069
H -3.838808 -1.770773 -2.407051
H -5.164642 -0.730022 -1.809839
H 4.059621 -1.738312 -2.702131
H 4.574007 -0.692016 -1.366798
H 5.400124 -1.806417 0.864828
H 5.427187 -3.576115 0.975968
H -5.176058 -1.284407 2.354670
H -3.906229 -2.339554 1.708873
H -4.265992 -3.450612 -0.647302
H -5.772352 -3.121741 -1.523554
H 4.511863 -3.781711 -1.339755
H 5.954010 -2.758950 -1.363272
H -6.125224 -3.193399 0.983779
H -6.564501 -1.619397 0.308126
H 0.671111 -2.372364 0.713910
H 1.364202 -1.535222 2.123850
H -2.347856 -0.000852 -2.224133
H -3.389307 1.184205 -1.388557
H -0.991889 -1.292222 -0.196268
H 2.400364 0.767285 1.294318
H 1.547410 4.366318 1.327721
H 3.014790 2.180030 2.957602
H 1.597477 3.089016 3.500426
H 3.119503 3.927327 3.180979
H 2.923247 3.530382 -0.605667
H 3.787359 2.409756 0.452168
H 3.945092 4.151595 0.695609
H -2.174612 3.875829 -0.314615


%chk=000191065-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191065

0 1
O -2.303115 3.298488 -0.591997
O -0.204738 4.364891 0.139518
N 2.499013 -1.594728 0.485172
N -3.588740 -0.665472 -0.461616
C 2.725016 -1.625646 -0.983535
C 3.178096 -2.720912 1.174292
C -4.027743 -0.784340 0.954550
C -4.633078 -1.149683 -1.400970
C 4.229643 -1.566199 -1.311904
C 4.697207 -2.695126 0.908423
C -4.366956 -2.245487 1.310775
C -4.989067 -2.623128 -1.117520
C 4.988891 -2.714755 -0.609565
C -5.439786 -2.807682 0.349951
C 1.067050 -1.485691 0.839070
C -3.122736 0.700589 -0.784415
C 0.462918 -0.106405 0.521948
C -1.707304 1.009978 -0.269197
C -0.858115 -0.084710 0.050891
C 1.299148 1.017735 0.794196
C 1.096966 2.398608 0.679007
C -1.358301 2.367982 -0.202496
C 2.257244 3.331423 1.060319
C -0.111983 3.056605 0.221300
C 2.632191 3.190754 2.559877
C 3.493657 3.098827 0.150980
H 2.199729 -0.764531 -1.435034
H 2.284942 -2.555799 -1.432088
H 2.766482 -3.709665 0.837580
H 2.979575 -2.635403 2.259732
H -4.924619 -0.137840 1.144298
H -3.215333 -0.409745 1.604305
H -4.249365 -1.042308 -2.432952
H -5.565098 -0.529538 -1.324930
H 4.368123 -1.618957 -2.408782
H 4.630800 -0.591562 -0.971095
H 5.120784 -1.774153 1.354223
H 5.172388 -3.560269 1.409615
H -4.716190 -2.296027 2.359947
H -3.445814 -2.856100 1.235077
H -4.095902 -3.248716 -1.311132
H -5.784774 -2.948993 -1.814762
H 4.659212 -3.685950 -1.034201
H 6.076376 -2.633824 -0.795820
H -5.632484 -3.875887 0.564383
H -6.395894 -2.267931 0.512006
H 0.445923 -2.274224 0.345519
H 0.989222 -1.663829 1.931908
H -3.118163 0.817349 -1.886955
H -3.815479 1.487167 -0.405591
H -1.352401 -1.055476 -0.110312
H 2.300040 0.713464 1.135920
H 1.897965 4.361974 0.892953
H 3.005768 2.175868 2.793707
H 1.761247 3.393412 3.208801
H 3.428865 3.912126 2.820317
H 3.237921 3.247770 -0.913580
H 3.898685 2.075302 0.266814
H 4.296739 3.812159 0.413766
H -1.800849 4.192117 -0.437989


