%chk=000299760.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299760

0 1
Cl 2.797517 3.508723 -2.068747
F -4.513144 1.843377 -1.020431
F -3.014500 1.475296 -2.460586
F -3.928831 -0.140830 -1.442550
O 3.341755 -0.417082 0.356740
N 1.025986 -0.353029 0.374661
N 2.357310 1.669348 0.435704
C -0.174377 0.427545 0.589423
C 0.880590 -1.795615 0.331877
C -1.186473 0.389787 -0.384213
C -2.349554 1.144007 -0.185055
C -0.325297 1.204136 1.752375
C 2.322198 0.251554 0.371197
C -2.504978 1.927602 0.964782
C -1.488964 1.952961 1.927063
C -0.172559 -2.403003 1.040237
C 1.766903 -2.571340 -0.435262
C 3.674709 2.306851 0.193699
C -3.424427 1.088468 -1.240322
C -0.339642 -3.786937 0.960198
C 1.585753 -3.954217 -0.494740
C 0.533386 -4.565585 0.194424
C 4.009281 2.444663 -1.289504
H -1.057754 -0.228289 -1.277775
H 0.463480 1.219479 2.508532
H -3.407454 2.519995 1.127035
H -1.611850 2.560281 2.825735
H -0.851604 -1.811689 1.651265
H 2.604065 -2.105549 -0.958981
H 1.562586 2.204342 0.072686
H 3.654297 3.305012 0.691733
H 4.471979 1.702103 0.698830
H -1.156518 -4.260964 1.504142
H 2.273927 -4.559430 -1.085171
H 0.397491 -5.643383 0.138420
H 3.990164 1.468341 -1.814143
H 5.007251 2.896969 -1.443279


%chk=000299760-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299760

0 1
Cl 2.831082 4.024282 -1.774751
F -4.191736 2.102629 -1.415840
F -3.068217 0.410025 -2.433646
F -4.459915 -0.028244 -0.701212
O 3.402605 -0.539836 0.608647
N 1.046487 -0.392199 0.460501
N 2.421736 1.542711 0.251798
C -0.130104 0.429460 0.588554
C 0.871299 -1.826264 0.346222
C -1.185299 0.293746 -0.347092
C -2.347317 1.080574 -0.208998
C -0.261526 1.351239 1.660819
C 2.363228 0.167001 0.456836
C -2.475186 2.016598 0.845239
C -1.421824 2.147142 1.774571
C -0.141717 -2.462701 1.107318
C 1.677209 -2.593535 -0.531600
C 3.708684 2.240037 0.222109
C -3.485229 0.898860 -1.174326
C -0.353513 -3.852241 0.980925
C 1.466772 -3.984225 -0.639902
C 0.449761 -4.621372 0.108432
C 4.090278 2.732432 -1.174803
H -1.090572 -0.418944 -1.171409
H 0.542723 1.434046 2.398621
H -3.376836 2.629829 0.931863
H -1.511889 2.858621 2.601396
H -0.758217 -1.875131 1.795518
H 2.471305 -2.110801 -1.105963
H 1.586566 2.073756 -0.001929
H 3.700444 3.092045 0.927382
H 4.473619 1.515080 0.558697
H -1.140895 -4.332529 1.572091
H 2.097351 -4.570350 -1.317398
H 0.287648 -5.700429 0.014800
H 4.064225 1.930014 -1.925672
H 5.059676 3.252575 -1.177798


