%chk=000252960.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252960

0 1
Cl 6.018426 0.829185 -0.402977
N 0.661288 -1.327963 -1.313698
N -0.406822 -0.758603 -0.650920
N 2.715458 -0.348919 -1.998486
N 1.682086 -1.141180 1.489314
N 3.921463 0.097610 -1.832195
C -2.758062 -0.403913 -0.344737
C 1.929533 -0.743171 -0.951830
C 2.403938 -0.669999 0.411240
C -3.985091 -1.082497 -0.449261
C -2.649590 0.718059 0.492019
C -1.609846 -0.886526 -1.141118
C 3.711063 -0.156803 0.579264
C -5.088748 -0.640452 0.282705
C -3.760592 1.155694 1.218340
C -4.979372 0.478671 1.115944
C 4.430906 0.209041 -0.561072
H -4.076510 -1.954771 -1.094170
H -1.699118 1.246367 0.571117
H -1.870168 -1.337522 -2.110473
H 4.154742 -0.063362 1.568553
H 0.580694 -1.474527 -2.339694
H -6.038196 -1.168340 0.203728
H -3.675097 2.028279 1.864536
H -5.843414 0.821881 1.682383
H 1.958640 -0.875176 2.419921
H 0.698588 -1.357762 1.370367


%chk=000252960-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252960

0 1
Cl 6.488859 -0.384263 -0.435019
N 0.691381 -0.927776 -1.330859
N -0.371074 -0.572052 -0.534916
N 2.890959 -1.175867 -1.945343
N 1.558642 0.306812 1.202426
N 4.255170 -1.069743 -1.781240
C -2.792620 -0.482946 -0.215493
C 2.034722 -0.731398 -0.980379
C 2.464096 -0.126459 0.263308
C -4.065643 -0.796103 -0.773073
C -2.745338 0.142894 1.065062
C -1.591568 -0.819358 -0.981694
C 3.868513 -0.025975 0.416017
C -5.253705 -0.496488 -0.075008
C -3.933024 0.440625 1.759113
C -5.193976 0.123083 1.194677
C 4.683193 -0.509506 -0.627161
H -4.118891 -1.276981 -1.757950
H -1.774573 0.391295 1.505746
H -1.745345 -1.299146 -1.966915
H 4.307883 0.413077 1.315110
H 0.554810 -1.373718 -2.251922
H -6.223715 -0.745108 -0.519064
H -3.882383 0.921319 2.742495
H -6.115473 0.356732 1.738705
H 1.874468 0.730425 2.071595
H 0.560831 0.179925 0.980582


