%chk=000222669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222669

0 1
O -2.237449 0.514551 0.139799
O -1.827092 -1.703889 0.091565
N 2.389962 -0.732610 -0.011031
N 1.650194 1.627749 0.050923
N 0.821688 -2.468126 0.001566
N 3.941717 1.037741 -0.026318
C 0.002969 -0.153209 0.065882
C 1.060908 -1.123369 0.019194
C -1.384909 -0.563735 0.098000
C -3.677497 0.208595 0.175638
C 0.377235 1.214644 0.079285
C 2.635179 0.621324 0.005258
C -4.331339 1.572375 0.212901
H -3.917255 -0.375055 -0.729754
H -3.866630 -0.400127 1.076465
H -0.402677 1.994545 0.114767
H -5.424124 1.487273 0.244441
H -4.010735 2.147556 1.092644
H -4.063348 2.170583 -0.669064
H -0.137587 -2.824605 0.023395
H 1.583001 -3.129055 -0.030675
H 4.693271 0.367291 -0.055617
H 4.163819 2.021152 -0.011666


%chk=000222669-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222669

0 1
O -2.242905 0.571268 0.146337
O -1.793719 -1.716237 0.091054
N 2.416358 -0.740557 -0.014955
N 1.755277 1.632636 0.052569
N 0.825405 -2.449591 -0.004395
N 3.998318 0.979508 -0.025879
C 0.041231 -0.121034 0.066765
C 1.097662 -1.112919 0.015701
C -1.366306 -0.516542 0.100535
C -3.697932 0.235433 0.184161
C 0.460835 1.236190 0.082090
C 2.681738 0.597501 0.004684
C -4.452775 1.560890 0.209792
H -3.939371 -0.373054 -0.706148
H -3.890888 -0.379899 1.081591
H -0.292787 2.028463 0.120387
H -5.540977 1.368703 0.238359
H -4.181146 2.153078 1.100277
H -4.229116 2.159538 -0.689608
H -0.159310 -2.742792 0.018186
H 1.606997 -3.101236 -0.040706
H 4.725274 0.269957 -0.061284
H 4.217440 1.972295 -0.011915


