%chk=000272609.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272609

0 1
O -2.419799 1.643928 0.899479
O 0.574556 -2.719153 1.432523
O -3.829188 0.354782 -0.323976
O 1.993241 -2.757824 -0.338406
N -1.644648 -0.764900 -1.784897
N -0.900409 -1.836644 -1.368557
C -0.268276 -0.049663 0.075270
C -1.439562 0.410187 -0.859854
C -0.072035 -1.485843 -0.414427
C 0.921683 0.863012 -0.063274
C -2.712059 0.754490 -0.102129
C 0.884440 2.095551 0.611853
C 2.034504 0.530417 -0.844546
C 0.961031 -2.380540 0.155435
C 1.959313 2.979582 0.511283
C 3.110165 1.420278 -0.939107
C 3.075919 2.642390 -0.263058
C -3.536776 2.095638 1.717274
C 1.478728 -3.588314 2.169569
H -0.591194 -0.077157 1.148876
H -1.140523 1.294660 -1.485844
H -2.621952 -0.992345 -2.025079
H 0.010583 2.361573 1.208763
H 2.075999 -0.420883 -1.381345
H 1.929665 3.933051 1.036152
H 3.976558 1.154310 -1.544196
H 3.914903 3.331872 -0.338216
H -4.324447 2.508179 1.078191
H -3.072909 2.863327 2.346049
H -3.914101 1.253626 2.306041
H 2.439307 -3.082813 2.309404
H 1.608942 -4.530031 1.626397
H 0.946643 -3.731741 3.116153


%chk=000272609-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272609

0 1
O -2.785587 1.413786 0.941483
O 1.008686 -1.964037 1.592573
O -3.898533 0.337512 -0.801268
O 0.840467 -3.613789 -0.062442
N -1.448384 -0.501442 -1.910156
N -0.838831 -1.663978 -1.480556
C -0.316199 0.054236 0.115903
C -1.435247 0.563989 -0.870141
C -0.189932 -1.406338 -0.345885
C 0.990140 0.840299 -0.020114
C -2.838161 0.725867 -0.260857
C 1.439278 1.663764 1.040294
C 1.754886 0.776954 -1.213588
C 0.581332 -2.454904 0.338386
C 2.629810 2.414347 0.913280
C 2.943952 1.527144 -1.342879
C 3.385494 2.349669 -0.279830
C -4.096585 1.695007 1.586207
C 1.815457 -2.913558 2.389533
H -0.658184 0.116542 1.160534
H -1.151120 1.539073 -1.305794
H -2.253029 -0.622485 -2.528792
H 0.858099 1.711677 1.968934
H 1.423377 0.133683 -2.038253
H 2.968411 3.045709 1.742606
H 3.527900 1.467011 -2.268167
H 4.309684 2.929940 -0.378860
H -4.720525 2.310176 0.917018
H -3.843201 2.236866 2.507298
H -4.618192 0.749306 1.806743
H 2.717971 -3.212851 1.830159
H 1.224888 -3.815165 2.626302
H 2.080181 -2.361010 3.302130


