%chk=000269898.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269898

0 1
O 3.357422 1.288742 -0.345762
N -0.513588 -0.450895 0.075951
N 0.013438 -1.735881 0.263787
N 1.290961 -1.688730 0.256229
N 0.487050 1.829434 -0.176294
N 4.119739 -0.804023 0.133743
N 5.487840 -0.449884 0.031521
C -1.929284 -0.183306 0.054183
C 0.564975 0.454392 -0.064401
C 1.722472 -0.363400 0.048077
C -2.430033 0.960086 0.697691
C -2.781841 -1.082915 -0.607479
C -3.803454 1.211191 0.649852
C -4.151975 -0.814985 -0.635360
C 3.095906 0.114274 -0.070703
C -4.662804 0.331186 -0.016259
H -1.769240 1.628553 1.250969
H -2.379029 -1.981961 -1.078916
H -4.205896 2.096005 1.144370
H -4.825426 -1.506617 -1.143332
H 1.390878 2.284950 -0.377904
H -0.301882 2.223794 -0.672087
H -5.732866 0.534270 -0.046576
H 3.966888 -1.793274 0.350529
H 5.670950 -0.037859 -0.895958
H 5.701498 0.297553 0.709326


%chk=000269898-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269898

0 1
O 3.343154 1.399259 -0.228480
N -0.498786 -0.397342 0.061622
N 0.002052 -1.773114 0.222102
N 1.327637 -1.674074 0.209630
N 0.542646 1.824122 -0.254043
N 4.091562 -0.800836 0.078132
N 5.471958 -0.487408 0.003997
C -1.904622 -0.152404 0.037333
C 0.565772 0.474145 -0.054350
C 1.720941 -0.346217 0.046535
C -2.442361 1.015368 0.635516
C -2.756788 -1.107803 -0.568398
C -3.836028 1.238702 0.593232
C -4.147942 -0.878950 -0.589310
C 3.094016 0.149901 -0.043270
C -4.692846 0.296855 -0.020685
H -1.791095 1.714837 1.171355
H -2.320449 -2.011530 -1.002188
H -4.251960 2.139409 1.057526
H -4.807719 -1.618654 -1.055171
H 1.475004 2.250501 -0.352072
H -0.313252 2.339334 -0.441824
H -5.773514 0.471415 -0.046911
H 3.844172 -1.783098 0.218917
H 5.700767 -0.072476 -0.910374
H 5.740380 0.150758 0.766374


