%chk=000227571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227571

0 1
Cl 3.960777 1.577333 0.222841
N -0.927232 0.010426 0.333398
N 0.793764 -1.587016 0.008603
N 0.956155 2.137756 0.480750
N 3.123208 -0.912352 -0.048716
C -3.362078 -0.455872 0.456465
C -1.966053 -1.050197 0.249733
C -3.859400 0.327860 -0.765782
C -5.248194 0.914670 -0.529447
C 0.402758 -0.265684 0.206647
C 1.398494 0.780115 0.279476
C 2.729771 0.373351 0.143457
C 2.118856 -1.842077 -0.107421
H -3.383541 0.188712 1.358121
H -4.068068 -1.282832 0.679367
H -1.886748 -1.567522 -0.736252
H -1.751917 -1.829948 1.020193
H -3.878672 -0.334876 -1.654240
H -3.148032 1.139423 -1.015947
H -1.224300 0.978573 0.467836
H -5.257995 1.610022 0.317781
H -5.597685 1.468541 -1.409002
H -5.989437 0.134292 -0.321402
H 1.360227 2.513737 1.340184
H 1.279789 2.729028 -0.286632
H 2.421252 -2.891765 -0.263712


%chk=000227571-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227571

0 1
Cl 4.055527 1.650771 -0.010276
N -0.893586 -0.020798 0.192910
N 0.847015 -1.633952 0.170643
N 0.994592 2.091751 0.242762
N 3.164986 -0.940354 0.042697
C -3.327895 -0.484806 0.437007
C -1.928209 -1.074113 0.174540
C -3.835138 0.483241 -0.660318
C -5.282260 0.956508 -0.403434
C 0.456314 -0.323446 0.176180
C 1.418639 0.759547 0.184270
C 2.758338 0.339032 0.080575
C 2.185498 -1.882879 0.120834
H -3.335379 0.027003 1.420418
H -4.039183 -1.330507 0.515052
H -1.912908 -1.612844 -0.796978
H -1.662681 -1.817480 0.945426
H -3.775586 -0.022201 -1.645254
H -3.177639 1.375973 -0.728366
H -1.160268 0.900471 -0.162972
H -5.361972 1.483648 0.565866
H -5.629123 1.646244 -1.193971
H -5.977705 0.096869 -0.375001
H 0.193377 2.317673 0.833729
H 1.719815 2.807147 0.170228
H 2.501129 -2.928798 0.129734


