%chk=000251288.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251288

0 1
O -3.408643 -0.219993 0.411386
O -0.155452 -0.213565 -0.544430
O 3.119994 -0.513247 -1.005792
O 3.206727 1.671341 -0.381288
N 4.253216 -1.313580 2.534788
C -5.737409 -0.156212 0.222802
C -4.503229 0.731807 0.380860
C -7.020873 0.679602 0.170612
C -2.110745 0.396860 0.578390
C -1.136408 -0.763605 0.372013
C -8.256560 -0.203105 0.013034
C 0.816591 -1.178662 -1.005483
C 1.857330 -0.324700 -1.722842
C 3.646557 0.553839 -0.325341
C 4.877808 0.076344 0.424424
C 4.524219 -0.694655 1.598157
H -5.776892 -0.884811 1.057249
H -5.632878 -0.772692 -0.692532
H -4.360130 1.415468 -0.473133
H -4.510599 1.303948 1.323762
H -7.113448 1.289089 1.091337
H -6.968833 1.400982 -0.668872
H -1.956021 1.183017 -0.186116
H -2.049199 0.834784 1.587931
H -0.626284 -1.070349 1.299337
H -1.646108 -1.630271 -0.090882
H -8.359677 -0.906598 0.847497
H -9.171546 0.398818 -0.023725
H -8.215534 -0.794832 -0.908919
H 0.312418 -1.890442 -1.682779
H 1.257454 -1.723458 -0.149069
H 2.093286 -0.675689 -2.741007
H 1.568520 0.748946 -1.731344
H 5.492253 0.969082 0.712892
H 5.521993 -0.536461 -0.258917


%chk=000251288-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251288

0 1
O -3.150823 -0.494817 -0.371752
O 0.360327 -0.788660 -1.390620
O 3.006380 -0.731819 -0.319172
O 3.094811 1.487449 -1.071322
N 0.601232 0.665986 2.366120
C -5.410496 -0.027844 0.378988
C -3.987552 0.527472 0.271501
C -6.385796 0.972634 1.041599
C -1.758812 -0.058111 -0.523011
C -1.000419 -1.257981 -1.088658
C -7.822097 0.416293 1.147820
C 1.303716 -1.872617 -1.635303
C 2.694337 -1.250270 -1.683631
C 3.048917 0.646359 -0.154963
C 3.044391 0.977592 1.348851
C 1.700205 0.801349 1.923596
H -5.381869 -0.969371 0.961185
H -5.769106 -0.289598 -0.635528
H -3.974499 1.462294 -0.334846
H -3.578758 0.767772 1.278955
H -6.014999 1.234427 2.053610
H -6.398249 1.917016 0.459642
H -1.688728 0.800940 -1.224670
H -1.327232 0.244083 0.453830
H -0.973513 -2.078669 -0.341424
H -1.499069 -1.628524 -2.008415
H -7.843619 -0.511987 1.749164
H -8.503354 1.144714 1.624704
H -8.228605 0.176548 0.147251
H 1.096959 -2.382667 -2.603806
H 1.251126 -2.629344 -0.822525
H 3.465421 -2.004659 -1.910100
H 2.739287 -0.415086 -2.403357
H 3.369199 2.023457 1.476727
H 3.753190 0.312638 1.873561


