%chk=000279778.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279778

0 1
I -4.975333 -1.826484 1.842996
O 3.506819 2.835375 0.824018
O 2.938584 2.105230 -1.218524
O 0.061186 0.761014 2.391733
O 4.338370 -2.721242 -2.005237
O 5.534058 -1.969957 -0.268614
N 0.947016 0.570613 0.305024
N -5.310782 -0.218439 -1.023176
C 2.318911 0.782306 0.789484
C 3.212805 -0.462559 0.652853
C 3.334205 -0.986914 -0.778842
C 2.920609 1.936166 -0.021640
C -0.143335 0.599033 1.201248
C -1.473240 0.399908 0.579923
C 4.520893 -1.890704 -0.920303
C -2.410729 -0.389283 1.266810
C -1.841352 1.014288 -0.631897
C -4.056359 0.000071 -0.498509
C -3.674313 -0.598911 0.734772
C -3.101856 0.823539 -1.168117
C -5.773951 0.388086 -2.283888
H 2.276295 1.082069 1.886733
H 4.224333 -0.231941 1.061718
H 2.809917 -1.261164 1.313853
H 3.438609 -0.147317 -1.512770
H 2.409427 -1.520964 -1.091697
H 0.834550 0.340009 -0.677616
H -2.125632 -0.833400 2.229710
H -1.129411 1.661388 -1.151069
H -3.367379 1.310867 -2.101857
H -5.981696 -0.798753 -0.515740
H 3.924147 3.607114 0.350171
H -5.140938 0.080303 -3.136592
H -5.770271 1.492515 -2.229812
H -6.806750 0.063966 -2.497113
H 5.109794 -3.330024 -2.158331


%chk=000279778-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279778

0 1
I -5.223271 -1.295932 2.133005
O 4.225789 2.510678 0.733633
O 2.492591 2.862174 -0.770150
O 0.284352 -0.332362 2.178244
O 4.256191 -2.368202 -2.231643
O 4.641898 -2.675976 0.037269
N 0.976309 0.885369 0.335045
N -5.374383 -0.163133 -0.982818
C 2.332841 1.021684 0.874986
C 3.192890 -0.271003 0.719917
C 3.353125 -0.706168 -0.746245
C 2.982749 2.214963 0.185540
C 0.001876 0.205213 1.055359
C -1.369378 0.139258 0.459839
C 4.139325 -1.994588 -0.881659
C -2.400639 -0.392661 1.281285
C -1.707257 0.553967 -0.854463
C -4.077434 -0.067970 -0.513846
C -3.712017 -0.488307 0.809205
C -3.023325 0.453325 -1.331538
C -5.791465 0.248310 -2.321782
H 2.269937 1.228776 1.961880
H 4.179613 -0.095651 1.182139
H 2.692527 -1.062762 1.302299
H 3.867216 0.063047 -1.356012
H 2.364556 -0.857312 -1.220562
H 0.747868 1.463613 -0.477875
H -2.123743 -0.722051 2.287103
H -0.945218 0.943547 -1.539888
H -3.252652 0.774468 -2.351609
H -6.074881 -0.549175 -0.347004
H 4.625835 3.290621 0.261766
H -5.264686 -0.322932 -3.112162
H -5.610631 1.327633 -2.496927
H -6.871890 0.063078 -2.432624
H 4.772583 -3.217738 -2.290004


