%chk=000254701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254701

0 1
Cl 4.646423 -0.138325 0.452070
O -3.457388 -0.183384 0.049043
O 0.731925 -2.005664 0.524804
O 2.539749 1.682916 0.082601
N -1.653010 1.242328 -0.066013
N -1.350305 -1.127172 0.292118
N 0.213166 2.723829 -0.185040
C 0.604925 0.352426 0.177100
C -0.261951 1.452842 -0.025785
C -2.249254 -0.071446 0.093928
C 0.091857 -0.985507 0.344691
C -2.598704 2.369743 -0.276677
C 2.054373 0.565537 0.219551
C -1.950516 -2.481225 0.457325
C 2.945769 -0.632334 0.437565
H -2.528137 3.108274 0.538681
H -3.645315 1.985876 -0.275880
H -2.435303 2.851100 -1.254829
H -1.146795 -3.228507 0.611286
H -2.527200 -2.760401 -0.440799
H -2.625367 -2.500927 1.329870
H 1.248621 2.885334 -0.156058
H -0.377527 3.524169 -0.330699
H 2.709319 -1.147134 1.397068
H 2.797745 -1.400348 -0.356023


%chk=000254701-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254701

0 1
Cl 4.787655 -0.081348 0.446535
O -3.519001 -0.205217 0.049608
O 0.734885 -2.065083 0.534432
O 2.534119 1.754725 0.077244
N -1.668024 1.230369 -0.064566
N -1.385250 -1.121488 0.289767
N 0.186519 2.692267 -0.181743
C 0.602063 0.327462 0.181473
C -0.290542 1.432159 -0.023564
C -2.267015 -0.059758 0.091747
C 0.050151 -1.011216 0.346739
C -2.588456 2.367390 -0.276711
C 2.050326 0.571258 0.219748
C -2.001315 -2.460269 0.451484
C 2.995576 -0.611771 0.436807
H -2.495463 3.107131 0.539053
H -3.609898 1.960577 -0.271768
H -2.401073 2.848762 -1.253701
H -1.182052 -3.177696 0.598822
H -2.584751 -2.717813 -0.447331
H -2.678643 -2.460832 1.320801
H 1.238361 2.744431 -0.136485
H -0.419178 3.495898 -0.329428
H 2.801779 -1.111888 1.396750
H 2.886328 -1.366051 -0.355812


