%chk=000257287.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257287

0 1
O 0.064290 -2.100834 -1.453710
O 0.474121 2.321236 0.338624
O -3.097807 -0.334563 1.321683
N -1.487220 -1.226013 -0.067505
N -1.271227 0.987655 0.838298
N 2.373380 1.421068 -1.677336
C 0.677487 0.028058 -0.454686
C 1.836683 -0.464574 0.452591
C 1.214634 0.502662 -1.838786
C -0.227031 -1.178440 -0.728414
C 0.003103 1.210086 0.242309
C 1.373141 -1.012432 1.793399
C -2.037047 -0.205903 0.753424
H 2.553569 0.374646 0.604206
H 2.416074 -1.232950 -0.104012
H 0.373403 0.937062 -2.422678
H 1.572873 -0.395332 -2.404974
H 0.829182 -0.269267 2.388267
H 0.731948 -1.896036 1.691223
H 2.237373 -1.323500 2.398351
H -2.062996 -2.075171 -0.195635
H -1.690413 1.766096 1.374516
H 2.114543 2.240423 -1.122591
H 2.684036 1.753325 -2.586263


%chk=000257287-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257287

0 1
O 0.187682 -2.374897 -0.915268
O 0.670216 2.095619 0.891751
O -3.503974 0.078715 0.497324
N -1.625025 -1.103147 -0.244765
N -1.390455 1.073669 0.635423
N 1.928020 1.579568 -1.855772
C 0.652280 -0.063158 -0.257430
C 1.996660 -0.481444 0.396708
C 0.962638 0.517501 -1.772186
C -0.243226 -1.274582 -0.476093
C 0.011710 1.095008 0.490353
C 1.848290 -1.082119 1.810429
C -2.263720 0.020853 0.306501
H 2.635152 0.418875 0.446831
H 2.479905 -1.217446 -0.272452
H -0.001729 0.847702 -2.200373
H 1.313274 -0.361008 -2.341964
H 1.381207 -0.362355 2.507476
H 1.244202 -2.007368 1.798071
H 2.841449 -1.340961 2.218899
H -2.234203 -1.898691 -0.462420
H -1.826890 1.893869 1.069111
H 1.684909 2.457643 -1.389867
H 2.907726 1.315457 -1.739983


