%chk=000245213.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245213

0 1
O -0.051132 1.586129 1.359252
O -4.726243 -4.039183 1.210374
O 5.602677 -2.998852 -0.503235
O -5.869376 -2.231561 0.887262
O 5.386973 -2.407958 1.567353
N -0.100131 -0.212650 -0.865858
N -0.072002 1.195776 -0.902764
N -4.824966 -2.864757 0.891203
N 4.992348 -2.479121 0.416192
C -1.276335 -0.830066 -0.305845
C 1.201950 -0.778171 -0.472391
C -1.215448 -2.189015 0.078989
C 1.934940 -1.396527 -1.499006
C -2.510916 -0.143952 -0.286577
C 1.693083 -0.711561 0.840042
C -0.051328 2.040614 0.233734
C -2.373624 -2.851144 0.466928
C 3.177559 -1.955969 -1.205099
C -3.666261 -0.809364 0.105107
C 2.936126 -1.269329 1.133628
C -3.599507 -2.162797 0.479366
C 3.668856 -1.887448 0.108065
C -0.043741 3.490951 -0.124300
C -1.056522 4.311316 0.391870
C 0.975285 4.030960 -0.920365
C -1.056349 5.676395 0.092648
C 0.970541 5.397772 -1.210756
C -0.045535 6.218513 -0.708294
H -0.128808 1.554976 -1.861533
H -0.268965 -2.730969 0.073001
H 1.533032 -1.440009 -2.513678
H -2.572022 0.904488 -0.575577
H 1.105630 -0.212690 1.626034
H -2.342889 -3.905934 0.767236
H 3.772895 -2.445903 -1.985099
H -4.632478 -0.290512 0.126578
H 3.344298 -1.229091 2.151255
H -1.832258 3.886862 1.032060
H 1.775659 3.395461 -1.299704
H -1.841890 6.319331 0.490314
H 1.762266 5.825353 -1.825830
H -0.046390 7.284832 -0.937581


%chk=000245213-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245213

0 1
O 0.334204 1.911743 1.443247
O -5.099337 -4.183682 0.417248
O 6.122785 -1.878272 -0.046857
O -6.088039 -2.177447 0.884931
O 5.272911 -3.297812 1.528551
N -0.079605 -0.241115 -0.281875
N -0.151552 1.101516 -0.687223
N -5.061715 -2.898957 0.568001
N 5.141830 -2.361373 0.645481
C -1.308967 -0.912840 -0.024654
C 1.219728 -0.779671 -0.045712
C -1.413448 -2.322156 -0.214803
C 2.330602 -0.289857 -0.786794
C -2.462407 -0.168222 0.350296
C 1.423411 -1.777799 0.948774
C 0.096360 2.150230 0.227452
C -2.639373 -2.973413 -0.016215
C 3.615873 -0.804491 -0.561453
C -3.691352 -0.816946 0.546659
C 2.706201 -2.297716 1.174957
C -3.771127 -2.215913 0.364664
C 3.793270 -1.813540 0.411681
C 0.048804 3.528772 -0.362593
C -0.175122 4.608401 0.531020
C 0.235829 3.793723 -1.746375
C -0.233634 5.930490 0.046802
C 0.179303 5.119500 -2.227684
C -0.061889 6.188951 -1.334218
H -0.533818 1.280440 -1.619324
H -0.542124 -2.896384 -0.541036
H 2.179886 0.493748 -1.533997
H -2.384909 0.909374 0.512730
H 0.586727 -2.113091 1.566765
H -2.742534 -4.051146 -0.166591
H 4.481318 -0.448117 -1.125868
H -4.584896 -0.265439 0.850139
H 2.886367 -3.054139 1.943054
H -0.291512 4.387146 1.596947
H 0.470410 2.985345 -2.449627
H -0.409483 6.758464 0.741441
H 0.334782 5.319992 -3.292980
H -0.104758 7.216898 -1.709962


