%chk=000259946.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259946

0 1
O 6.324699 1.861235 -1.390389
N 6.379310 -0.067685 -0.121242
N -3.336873 -0.229854 0.413963
N -6.085784 0.550126 -1.745107
C 1.456081 1.065644 -0.695878
C 2.676960 0.301842 -0.236790
C 0.314304 0.254536 -0.128193
C 2.284579 -0.841748 0.527328
C 0.820809 -0.871395 0.596178
C 4.007614 0.589608 -0.471641
C -1.044487 0.478882 -0.238305
C 3.246591 -1.692306 1.053341
C -0.048498 -1.759225 1.214606
C 4.977560 -0.284724 0.069348
C 4.601063 -1.413821 0.824000
C -1.921764 -0.434595 0.397635
C -1.430000 -1.534734 1.118390
C 6.974157 0.995723 -0.841796
C -4.003817 0.050796 -0.658601
C 8.477251 0.942738 -0.857249
C -5.472889 0.272647 -0.554401
C -6.179594 0.206676 0.659671
C -7.559781 0.432686 0.644447
C -7.422334 0.765955 -1.739352
C -8.196782 0.716092 -0.564950
H 1.406896 1.137952 -1.799700
H 1.454823 2.105564 -0.314612
H 4.306691 1.464955 -1.056645
H -1.434533 1.336728 -0.778717
H 2.960779 -2.565456 1.637005
H 0.328551 -2.615422 1.769753
H 5.352687 -2.080994 1.236714
H -2.128125 -2.214295 1.606916
H 6.993051 -0.759798 0.313861
H -3.601424 0.140936 -1.684675
H 8.912918 1.012052 0.148132
H 8.872129 1.797222 -1.434119
H 8.863254 0.033143 -1.335818
H -5.649845 -0.016854 1.588252
H -8.130884 0.387282 1.572027
H -7.878106 0.985178 -2.712329
H -9.268239 0.895608 -0.604757


%chk=000259946-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259946

0 1
O 6.431877 1.857984 -1.574370
N 6.409174 -0.020006 -0.161922
N -3.389320 -0.366670 0.437222
N -6.048315 0.901636 -1.671288
C 1.422957 1.019212 -0.770097
C 2.669942 0.296982 -0.272739
C 0.288350 0.215491 -0.143265
C 2.293831 -0.799098 0.563416
C 0.827313 -0.851246 0.645738
C 4.013896 0.592778 -0.542488
C -1.094081 0.406786 -0.247372
C 3.292849 -1.613623 1.143115
C -0.038695 -1.719422 1.350967
C 5.015467 -0.232170 0.044686
C 4.645831 -1.326060 0.880958
C -1.974988 -0.478224 0.451403
C -1.429292 -1.517342 1.261112
C 7.047727 0.964191 -0.923436
C -4.035948 0.165210 -0.571983
C 8.574031 0.863236 -0.899918
C -5.499791 0.338561 -0.540974
C -6.283977 -0.051651 0.580071
C -7.677841 0.143122 0.533737
C -7.398623 1.082355 -1.694348
C -8.252389 0.721774 -0.624988
H 1.366214 1.028587 -1.875972
H 1.406594 2.078257 -0.446124
H 4.313251 1.426450 -1.180240
H -1.501046 1.241184 -0.830558
H 3.029942 -2.459449 1.787437
H 0.358441 -2.531750 1.969501
H 5.429478 -1.953216 1.326164
H -2.132593 -2.157186 1.803201
H 7.024089 -0.683280 0.316399
H -3.560283 0.497568 -1.515185
H 8.969016 0.963793 0.128197
H 8.986540 1.674013 -1.516981
H 8.920456 -0.104377 -1.308414
H -5.777271 -0.491600 1.443674
H -8.308604 -0.147737 1.380595
H -7.803970 1.533107 -2.607697
H -9.331241 0.890731 -0.700934


