%chk=000243944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243944

0 1
O -0.912486 4.173111 -0.522023
O -0.259066 3.231747 -2.450974
N 0.203604 0.880917 -0.818413
N 0.794311 0.682590 1.481062
N 3.673952 -2.052515 0.408485
N 2.593191 -0.776461 2.266928
N 3.515269 -2.141559 -0.954885
C -0.905529 1.804742 -0.519704
C -2.271442 1.245660 -0.963139
C -2.584375 -0.092748 -0.348956
C 0.976521 0.304153 0.170881
C 1.985825 -0.647934 -0.153724
C -0.633091 3.091229 -1.313397
C -3.035821 -1.139290 -1.167222
C -2.454554 -0.298092 1.032893
C 2.763541 -1.150968 0.953001
C 2.513435 -1.311819 -1.315110
C -3.355577 -2.378734 -0.605472
C -2.772819 -1.540063 1.587599
C -3.225017 -2.582161 0.771407
C 1.605468 0.131331 2.447250
H -0.926846 2.050430 0.587700
H -2.320102 1.186356 -2.072070
H -3.068937 1.968573 -0.674515
H 0.271716 0.535275 -1.774354
H -3.142029 -0.992529 -2.239984
H -2.091718 0.503477 1.677232
H 2.192529 -1.195596 -2.338590
H -3.706425 -3.187991 -1.244296
H -2.666230 -1.696148 2.660500
H 4.378942 -2.596261 0.887876
H -3.472565 -3.548231 1.206847
H 1.416950 0.475834 3.479257
H -0.750223 5.044374 -0.978889


%chk=000243944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243944

0 1
O -1.313142 4.092619 -0.733054
O 0.227918 3.197896 -2.226669
N 0.237946 0.783231 -0.815445
N 0.829950 0.587999 1.464776
N 3.899828 -1.897362 0.419601
N 2.710372 -0.772800 2.266632
N 3.822645 -1.994033 -0.973382
C -0.829595 1.738335 -0.522671
C -2.248566 1.229248 -0.943695
C -2.653336 -0.104429 -0.326195
C 1.064384 0.260743 0.152967
C 2.154287 -0.614595 -0.167835
C -0.545947 3.051318 -1.255787
C -3.289256 -1.083186 -1.131262
C -2.463604 -0.379375 1.052684
C 2.920548 -1.081736 0.949672
C 2.762129 -1.213991 -1.322348
C -3.735407 -2.303957 -0.575848
C -2.906638 -1.598779 1.610177
C -3.546899 -2.565368 0.800194
C 1.650231 0.063576 2.429928
H -0.802264 1.922294 0.564669
H -2.289053 1.151240 -2.047895
H -2.969096 2.018923 -0.653803
H 0.483642 0.637766 -1.796079
H -3.438528 -0.888020 -2.200878
H -1.949046 0.345478 1.693346
H 2.501047 -1.131971 -2.376291
H -4.225123 -3.047493 -1.214809
H -2.747336 -1.796183 2.676193
H 4.628473 -2.403908 0.917847
H -3.888861 -3.511292 1.234732
H 1.419867 0.358857 3.458018
H -1.141169 4.929654 -1.244291


