%chk=000238639.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238639

0 1
O -4.916177 0.948032 0.341103
O -4.534756 -1.079004 0.988831
N 1.312606 0.736132 -0.613134
N 2.080620 -2.387105 -1.787034
N -4.169415 0.001277 0.547121
C 2.437664 -0.201355 -0.359378
C 2.595935 -0.538818 1.151287
C 3.770574 0.473323 -0.796690
C 3.896069 0.128592 1.630265
C 4.394449 1.031069 0.488574
C 2.224073 -1.429892 -1.160076
C -0.025496 0.508072 -0.305568
C -0.939673 1.580553 -0.523020
C -0.503482 -0.731379 0.191640
C -2.284002 1.408805 -0.248963
C -1.853413 -0.892097 0.460738
C -2.749514 0.174254 0.250305
H 2.630145 -1.630688 1.318026
H 1.729469 -0.175426 1.735108
H 3.627605 1.248702 -1.567744
H 4.443513 -0.276786 -1.258647
H 4.653531 -0.636863 1.880056
H 3.730293 0.708573 2.554642
H 4.083078 2.078321 0.654612
H 5.496484 1.042503 0.431337
H 1.578426 1.664984 -0.939563
H -0.585925 2.533570 -0.909159
H 0.171014 -1.569778 0.347998
H -3.000673 2.223132 -0.412176
H -2.238519 -1.847202 0.839807


%chk=000238639-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238639

0 1
O -4.931696 1.115022 0.376346
O -4.586647 -1.045862 1.034842
N 1.372032 0.683106 -0.583961
N 2.101740 -2.457237 -1.936340
N -4.162609 0.090894 0.579040
C 2.467388 -0.292782 -0.393473
C 2.666290 -0.670525 1.130766
C 3.813484 0.411248 -0.772768
C 3.879725 0.171996 1.638864
C 4.193598 1.187282 0.507827
C 2.252868 -1.495915 -1.245733
C 0.022937 0.495632 -0.294336
C -0.876663 1.591537 -0.492790
C -0.501429 -0.743671 0.189374
C -2.240882 1.463251 -0.211936
C -1.869107 -0.872615 0.472220
C -2.733712 0.228647 0.277490
H 2.851900 -1.753151 1.239107
H 1.743370 -0.436931 1.685599
H 3.712747 1.032311 -1.681786
H 4.571476 -0.363467 -0.984527
H 4.753484 -0.484991 1.801639
H 3.660691 0.670951 2.598068
H 3.571378 2.095507 0.614332
H 5.250364 1.504722 0.501063
H 1.631814 1.557501 -1.042921
H -0.488368 2.546098 -0.868188
H 0.148566 -1.612692 0.315912
H -2.935728 2.294236 -0.358256
H -2.284507 -1.816602 0.834826


