%chk=000250869.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250869

0 1
Cl 6.138630 2.653079 0.300801
Cl 6.339343 -2.300253 0.633902
Cl 0.159650 -1.323092 -2.811736
F -7.900871 0.141612 0.250093
N 4.060046 0.069606 0.175408
N -2.384299 0.080228 0.435212
C 4.654358 0.652363 1.400370
C 5.007726 -0.439616 -0.842406
C 2.681003 -0.003812 -0.005098
C 2.134898 -0.564785 -1.190517
C 1.785591 0.480527 0.989188
C 4.745586 2.177012 1.319907
C 5.221445 -1.949071 -0.720042
C -0.145163 -0.146266 -0.377421
C 0.756686 -0.619382 -1.341987
C 0.415543 0.403148 0.798862
C -1.602281 -0.210883 -0.561590
C -3.806087 0.063672 0.304648
C -4.533048 -0.564847 1.338595
C -4.479129 0.724633 -0.741500
C -5.926016 -0.544884 1.321941
C -5.874782 0.758776 -0.763337
C -6.565709 0.118437 0.268222
H 4.046273 0.360254 2.292243
H 5.665202 0.205895 1.572178
H 4.629003 -0.196867 -1.866346
H 5.980191 0.104776 -0.750019
H 2.779444 -0.943032 -1.980089
H 2.165437 0.907192 1.913541
H 3.837839 2.629173 0.872101
H 4.901167 2.624899 2.319897
H 4.276330 -2.492722 -0.518835
H 5.675058 -2.367903 -1.638575
H -0.263008 0.775757 1.576740
H -1.950539 -0.516375 -1.563807
H -3.996297 -1.061773 2.148187
H -3.914210 1.224490 -1.526971
H -6.498472 -1.030173 2.111649
H -6.404640 1.272009 -1.564708


%chk=000250869-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250869

0 1
Cl 5.877715 2.891524 0.258795
Cl 6.153836 -2.542255 0.525737
Cl 0.148243 -1.199320 -2.942204
F -8.024860 0.119337 0.116926
N 4.126105 0.071709 0.181367
N -2.403229 0.092237 0.517776
C 4.721045 0.590400 1.424760
C 5.043120 -0.359870 -0.887177
C 2.737745 -0.007828 0.021027
C 2.159714 -0.495148 -1.194753
C 1.832049 0.393713 1.061598
C 4.717475 2.121157 1.541419
C 5.230899 -1.880488 -0.989119
C -0.145114 -0.179382 -0.319691
C 0.768366 -0.563732 -1.334602
C 0.449119 0.302994 0.885515
C -1.599969 -0.259638 -0.462443
C -3.812391 0.090465 0.350494
C -4.604487 -0.159365 1.506828
C -4.468124 0.382229 -0.883635
C -6.011311 -0.167183 1.434883
C -5.875303 0.394793 -0.965254
C -6.616071 0.108136 0.194940
H 4.187333 0.176354 2.303608
H 5.755159 0.216215 1.497673
H 4.684158 0.010592 -1.868810
H 6.020510 0.122723 -0.724652
H 2.779618 -0.816588 -2.033025
H 2.209315 0.775100 2.013632
H 3.732607 2.565533 1.339445
H 5.105027 2.450272 2.518125
H 4.280206 -2.431807 -1.008163
H 5.859009 -2.150323 -1.852252
H -0.239746 0.605662 1.681136
H -1.974377 -0.654150 -1.426351
H -4.090589 -0.354517 2.452665
H -3.877021 0.633255 -1.771275
H -6.630268 -0.370622 2.313363
H -6.393613 0.629618 -1.899605


