%chk=000229627.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229627

0 1
Cl 5.993105 -2.335718 0.730673
Cl 5.981753 2.391600 -0.737473
N 3.754542 0.034108 -0.017022
N -2.718857 1.085604 0.356694
N -2.696176 -1.120654 -0.281355
C 2.356906 0.006971 0.009090
C 4.529943 -0.789273 -0.970922
C 4.535863 0.825631 0.958946
C -0.469110 -0.016027 0.037074
C -1.927667 -0.058083 0.031086
C 1.630589 -0.779064 -0.924993
C 1.635041 0.772655 0.963334
C 0.243135 -0.787552 -0.902484
C 0.246096 0.748892 0.973219
C -4.065500 0.693221 0.234327
C -4.034432 -0.690298 -0.165098
C 4.688941 -2.234112 -0.493205
C 4.697730 2.278456 0.506446
C -5.275178 1.379556 0.427276
C -5.238713 -1.388011 -0.370615
C -6.443475 0.663435 0.215186
C -6.425689 -0.699599 -0.177380
H 4.025298 -0.780895 -1.968907
H 5.529292 -0.317245 -1.140080
H 4.036716 0.799971 1.959013
H 5.535420 0.349724 1.114946
H 2.148750 -1.378790 -1.667930
H 2.158375 1.369455 1.704305
H -0.312440 -1.403297 -1.617488
H -0.289070 1.324952 1.729268
H -2.391377 2.002317 0.588860
H 3.763655 -2.624991 -0.023788
H 4.968084 -2.906826 -1.326039
H 4.996899 2.932487 1.346834
H 3.768134 2.682899 0.058833
H -5.288970 2.421367 0.728011
H -5.214838 -2.433909 -0.670401
H -7.407532 1.152236 0.351414
H -7.376443 -1.208895 -0.327756


%chk=000229627-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229627

0 1
Cl 5.722268 -2.376809 1.320345
Cl 5.758430 2.372827 -1.344317
N 3.816342 0.013636 -0.005264
N -2.758036 0.846698 0.791110
N -2.687573 -0.802479 -0.786446
C 2.410722 0.026445 0.003424
C 4.562375 -0.949700 -0.829078
C 4.590703 0.960026 0.810719
C -0.481281 0.047034 0.021103
C -1.944211 0.016022 -0.005600
C 1.647103 -0.877605 -0.806556
C 1.673586 0.942100 0.820542
C 0.246415 -0.859683 -0.797262
C 0.268280 0.943529 0.827835
C -4.096566 0.544303 0.504413
C -4.029411 -0.494700 -0.489528
C 4.645025 -2.364896 -0.238548
C 4.694368 2.375081 0.222574
C -5.318366 1.049268 0.992146
C -5.223094 -1.043891 -1.012930
C -6.497731 0.485830 0.455772
C -6.450279 -0.543228 -0.530556
H 4.103511 -1.026857 -1.835757
H 5.579852 -0.558374 -0.993026
H 4.145733 1.043830 1.823539
H 5.602252 0.548898 0.962091
H 2.145984 -1.603019 -1.455230
H 2.191214 1.661223 1.461374
H -0.322827 -1.553316 -1.424190
H -0.235300 1.670543 1.477853
H -2.432328 1.539743 1.460699
H 3.668528 -2.751807 0.085431
H 5.135221 -3.064897 -0.933166
H 5.202510 3.064277 0.915264
H 3.722162 2.779850 -0.092678
H -5.364719 1.839487 1.749146
H -5.180717 -1.833487 -1.769220
H -7.471340 0.847253 0.805009
H -7.390007 -0.950855 -0.919136


