%chk=000179076.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179076

0 1
Cl 0.228703 -0.952477 1.666814
F -5.962555 -0.998973 0.700702
F -4.636021 -2.161759 -0.460800
F -4.276450 -1.888260 1.608439
O 3.156007 -1.127727 1.387213
N 4.324538 -0.342760 -0.414301
N -0.207205 0.760329 -0.410776
N 0.474007 1.434858 -1.394185
C 5.574188 -0.947234 0.027695
C 6.529245 -1.505967 -1.019001
C 6.881935 -0.228870 -0.277958
C 3.157759 -0.489881 0.345704
C 1.952200 0.162946 -0.190356
C 0.672227 -0.021632 0.351304
C 1.778372 1.082235 -1.278298
C -1.631517 0.921387 -0.252331
C -2.429695 -0.198837 0.022603
C -3.809097 -0.015047 0.194526
C -2.195072 2.204036 -0.387830
C -4.382215 1.256123 0.073823
C -3.570884 2.357980 -0.223610
C -4.654226 -1.224929 0.502440
H 5.457036 -1.475790 0.992792
H 6.278336 -1.461645 -2.075475
H 7.072079 -2.423971 -0.802953
H 7.675936 -0.237316 0.466054
H 6.880601 0.718340 -0.810605
H 4.333755 0.158934 -1.293534
H 2.537281 1.475354 -1.937787
H -1.989345 -1.197931 0.089163
H -1.559658 3.062078 -0.627492
H -5.456491 1.406320 0.204234
H -4.020574 3.347889 -0.326813


%chk=000179076-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179076

0 1
Cl 0.267021 -1.408656 1.463361
F -5.851792 -1.196108 -0.662659
F -3.980342 -2.479857 -0.545912
F -4.970788 -1.735746 1.350641
O 3.457940 -1.010961 1.515466
N 4.408817 -0.015526 -0.363839
N -0.146421 0.858523 -0.120403
N 0.534805 1.878018 -0.814724
C 5.742760 -0.494728 -0.071267
C 6.165032 -1.906371 -0.503778
C 6.723110 -0.671126 -1.231670
C 3.337574 -0.287427 0.481304
C 2.053966 0.357591 0.078181
C 0.755017 -0.045682 0.433015
C 1.847461 1.550976 -0.690146
C -1.578187 0.928550 -0.059032
C -2.369100 -0.240659 -0.069014
C -3.774131 -0.114854 -0.017991
C -2.183820 2.208037 -0.031515
C -4.394964 1.154432 0.022510
C -3.588448 2.312254 0.005687
C -4.622518 -1.355057 0.022546
H 6.138182 -0.143635 0.887463
H 5.417558 -2.509604 -1.025502
H 6.820246 -2.465584 0.168460
H 7.765662 -0.386814 -1.067182
H 6.359728 -0.480395 -2.247321
H 4.259728 0.534681 -1.211034
H 2.591712 2.212141 -1.132799
H -1.912960 -1.230085 -0.138273
H -1.547744 3.096229 -0.052811
H -5.485619 1.234144 0.051756
H -4.056284 3.301102 0.025883


