%chk=000258308.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258308

0 1
O -4.372675 1.512750 -0.231421
N 0.114095 -0.284925 0.586573
N -2.748647 -0.145368 -0.311300
N -4.966192 -0.533319 0.609019
C -0.637343 0.994944 0.416015
C -0.699135 -1.483051 0.204830
C -1.734551 0.896883 -0.656203
C -2.194094 -1.271554 0.502087
C 1.491881 -0.312035 0.213727
C -4.042523 0.362155 0.019441
C 2.255452 0.875548 0.244949
C 2.141128 -1.536788 -0.066464
C 3.634530 0.840356 0.011787
C 3.516704 -1.553404 -0.296113
C 4.271570 -0.380071 -0.263506
C 4.420571 2.111822 0.059555
H 0.047404 1.840977 0.176404
H -1.085875 1.233454 1.409771
H -0.329992 -2.342412 0.813106
H -0.562860 -1.748904 -0.869027
H -2.232996 1.887917 -0.794898
H -1.305219 0.615279 -1.644516
H -2.749711 -2.197470 0.231220
H -2.342874 -1.095768 1.593034
H 1.775990 1.827734 0.464760
H 1.595037 -2.472817 -0.092440
H 4.009701 -2.503181 -0.507050
H 5.340415 -0.413140 -0.446823
H -5.930070 -0.214087 0.614039
H -4.873317 -1.526712 0.468513
H 4.384521 2.560527 1.062939
H 5.479482 1.966101 -0.189767
H 4.022892 2.856161 -0.644341


%chk=000258308-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258308

0 1
O -4.639896 1.425735 -0.045971
N 0.067268 -0.246169 -0.231770
N -2.806729 -0.036589 -0.069026
N -4.724857 -0.513530 1.237247
C -0.608921 1.062271 -0.382241
C -0.775874 -1.448013 -0.302528
C -2.032191 0.873259 -0.933971
C -2.117995 -1.242229 0.432114
C 1.467111 -0.319893 -0.119296
C -4.082520 0.352606 0.349868
C 2.233512 0.854558 0.152138
C 2.170939 -1.555714 -0.275063
C 3.642522 0.813600 0.276578
C 3.571961 -1.594693 -0.142662
C 4.316311 -0.424421 0.131734
C 4.413762 2.089972 0.576983
H -0.036316 1.697318 -1.088145
H -0.658344 1.602968 0.587503
H -0.257536 -2.286133 0.193980
H -0.972407 -1.759245 -1.352318
H -2.570954 1.834686 -0.961449
H -1.987389 0.483701 -1.970950
H -2.738977 -2.147405 0.263637
H -1.919237 -1.156037 1.522574
H 1.727590 1.815896 0.292860
H 1.639066 -2.476951 -0.531517
H 4.091331 -2.551869 -0.270952
H 5.406907 -0.469996 0.226104
H -5.655023 -0.234073 1.537090
H -4.313802 -1.363391 1.613239
H 4.117444 2.518703 1.553189
H 5.500899 1.903569 0.608532
H 4.225642 2.865109 -0.189611


