%chk=000221298.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221298

0 1
O 2.203810 0.778866 -0.848026
O -1.395332 -2.052997 -0.800864
O 3.486475 1.344058 0.924867
N -0.715244 -0.160730 0.279006
C 0.388775 0.678027 0.807761
C -2.031162 0.441093 0.247657
C 1.068267 1.502878 -0.294027
C -0.474181 -1.440822 -0.296016
C 0.948140 -1.959372 -0.228107
C -2.857977 0.290691 -0.880694
C -2.479828 1.182684 1.357070
C 1.012181 -3.423142 -0.642966
C -4.119224 0.887876 -0.893439
C -3.742080 1.777989 1.323151
C -4.563565 1.637469 0.200757
C 3.392304 0.784637 -0.139865
C 4.416657 0.016512 -0.928883
C 4.890883 -1.197184 -0.140315
H -0.003142 1.365840 1.595453
H 1.142352 0.041630 1.329689
H 1.421358 2.478706 0.085628
H 0.434942 1.642346 -1.191109
H 1.366363 -1.833416 0.792068
H 1.585612 -1.337100 -0.901191
H -2.529692 -0.316088 -1.727439
H -1.858423 1.282349 2.244615
H 0.456892 -4.063888 0.055306
H 0.552617 -3.577338 -1.630852
H 2.044579 -3.782918 -0.688021
H -4.761622 0.765183 -1.765349
H -4.089137 2.350820 2.182386
H -5.546349 2.102283 0.181207
H 5.269786 0.695085 -1.153608
H 4.002683 -0.291725 -1.914829
H 4.085006 -1.926273 0.013556
H 5.702744 -1.714367 -0.668165
H 5.275033 -0.911863 0.849985


%chk=000221298-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221298

0 1
O 1.742156 1.154045 -0.481806
O -1.265993 -2.226894 -0.593718
O 3.506519 0.434995 0.863192
N -0.635986 -0.339124 0.627556
C 0.342575 0.390432 1.464610
C -1.805507 0.406602 0.200416
C 0.998956 1.579189 0.735771
C -0.436138 -1.661358 0.177404
C 0.808421 -2.407547 0.693285
C -2.156058 0.480185 -1.170360
C -2.590919 1.091563 1.160669
C 0.897832 -3.830501 0.112204
C -3.281052 1.232465 -1.569792
C -3.710001 1.851529 0.753371
C -4.060413 1.925263 -0.613806
C 3.016928 0.606245 -0.277555
C 3.674053 0.285989 -1.609436
C 4.917420 -0.609668 -1.462726
H -0.155105 0.798329 2.366224
H 1.125218 -0.294165 1.816566
H 1.694538 2.089797 1.426624
H 0.246234 2.284067 0.350719
H 0.770965 -2.457417 1.800546
H 1.725920 -1.840306 0.444137
H -1.558425 -0.059347 -1.908219
H -2.347218 1.014420 2.226224
H -0.000144 -4.416781 0.367967
H 0.962791 -3.803784 -0.988573
H 1.789098 -4.348735 0.509796
H -3.547141 1.279392 -2.631571
H -4.312233 2.373405 1.505389
H -4.931242 2.509980 -0.929725
H 3.941214 1.250989 -2.084622
H 2.913429 -0.170072 -2.269234
H 4.650900 -1.596876 -1.046279
H 5.393740 -0.766889 -2.446143
H 5.655173 -0.151614 -0.782710


