%chk=000191115.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191115

0 1
O 1.106844 -0.960002 1.466984
O 5.427203 -1.484270 0.509509
O -2.039912 1.037442 -1.285411
O -6.087898 -1.009671 -1.204176
N 2.285016 -0.695923 -0.453798
N -0.930817 0.638215 0.665737
N -4.539800 0.454015 -0.316016
N 3.828529 -1.490737 2.119964
C 3.135427 -1.899127 -0.229773
C 3.740388 -2.224627 -1.607897
C 2.558123 -0.061664 -1.778062
C 3.626179 -0.941647 -2.450328
C 0.396229 0.878540 0.057931
C 1.275209 -0.337814 0.417805
C 1.060399 2.152916 0.606045
C 0.282497 3.438931 0.244184
C -3.402023 0.415362 0.629886
C 4.247808 -1.583351 0.802527
C -3.442672 -0.997932 1.274067
C -2.083350 0.710675 -0.109938
C -4.654045 -1.716985 0.662963
C 0.999535 4.653153 0.847977
C 0.120907 3.600627 -1.269822
C -5.200283 -0.791480 -0.412864
H 2.506875 -2.743432 0.157990
H 4.801245 -2.538602 -1.511731
H 3.200025 -3.062696 -2.080977
H 1.624943 -0.018928 -2.380941
H 2.919902 0.978042 -1.629302
H 3.361508 -1.170652 -3.496382
H 4.601334 -0.417440 -2.478275
H 0.260180 0.970195 -1.060717
H 2.095614 2.222651 0.216900
H 1.160807 2.085367 1.708059
H -0.737909 3.370144 0.699061
H -3.558313 1.213303 1.404603
H -0.928521 0.328091 1.637445
H -2.514172 -1.565936 1.079822
H -3.535551 -0.920866 2.371441
H -4.385371 -2.694582 0.220360
H -5.438852 -1.930891 1.413291
H -4.486932 1.095343 -1.108057
H 1.106074 4.565424 1.934115
H 0.442810 5.576714 0.650195
H 2.001861 4.787375 0.426795
H -0.520634 2.809688 -1.690262
H -0.360089 4.554220 -1.517108
H 1.079496 3.577601 -1.794945
H 2.842938 -1.466289 2.377317
H 4.492836 -1.250392 2.839807


%chk=000191115-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191115

0 1
O 1.028627 -1.066328 1.362050
O 5.497818 -1.526111 0.560670
O -2.148896 1.289640 -1.367112
O -6.416716 -1.132074 -0.818911
N 2.312491 -0.717863 -0.545007
N -0.949643 0.521702 0.479761
N -4.517593 0.217334 -0.425082
N 3.724180 -1.462610 2.075234
C 3.194046 -1.905635 -0.288475
C 3.847547 -2.167702 -1.659444
C 2.627156 -0.066525 -1.854973
C 3.938435 -0.756541 -2.294200
C 0.382666 0.798050 -0.079737
C 1.269801 -0.408299 0.278880
C 1.019773 2.092434 0.517128
C 0.277406 3.407170 0.162324
C -3.407706 0.352845 0.523132
C 4.259281 -1.605830 0.817054
C -3.401662 -1.032427 1.252894
C -2.113524 0.748908 -0.216026
C -4.866929 -1.520603 1.122786
C 0.883123 4.574966 0.977343
C 0.318133 3.709461 -1.354499
C -5.392416 -0.825823 -0.152915
H 2.556509 -2.737027 0.064814
H 4.841167 -2.624787 -1.536821
H 3.207175 -2.833974 -2.265038
H 1.808266 -0.259482 -2.575123
H 2.739059 1.025344 -1.739108
H 4.035851 -0.783811 -3.391720
H 4.811586 -0.226882 -1.876635
H 0.262022 0.908322 -1.171596
H 2.070483 2.170568 0.167582
H 1.060106 1.969788 1.618121
H -0.784875 3.291976 0.460004
H -3.616512 1.161689 1.259015
H -0.941975 -0.038551 1.340761
H -2.724533 -1.727412 0.724039
H -3.065044 -0.950649 2.300352
H -4.965304 -2.612881 1.022363
H -5.491167 -1.205891 1.980149
H -4.573569 0.805521 -1.258907
H 0.826600 4.384190 2.065606
H 0.347029 5.518996 0.769487
H 1.947997 4.729414 0.715215
H -0.238492 2.951915 -1.933400
H -0.149441 4.688676 -1.565450
H 1.363405 3.753478 -1.720559
H 2.698995 -1.476427 2.195021
H 4.350862 -1.262143 2.854951


