%chk=000258829.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258829

0 1
Cl 8.096154 -0.907718 0.450192
O -0.021650 -1.496633 0.571731
O 1.923024 1.809539 0.256174
N 0.225123 0.098776 -1.057829
N 1.623915 -0.047715 -1.061329
C -4.324876 -0.597620 -0.143840
C -4.611875 0.730490 0.268246
C -1.947016 -0.136076 0.041506
C -2.962163 -1.018227 -0.246946
C -3.530526 1.617822 0.574605
C -2.229673 1.198402 0.463680
C -5.406008 -1.486826 -0.444580
C -5.977160 1.148626 0.370589
C -0.525264 -0.580610 -0.046567
C -6.705189 -1.059160 -0.337387
C -6.993745 0.275611 0.075054
C 3.816915 0.347818 -0.054413
C 2.397642 0.789128 -0.198845
C 4.842427 1.177004 -0.530281
C 4.112287 -0.862551 0.589585
C 6.175883 0.788750 -0.378330
C 5.442717 -1.255540 0.750986
C 6.452993 -0.423258 0.259838
H -2.744259 -2.043755 -0.552285
H -3.762407 2.631904 0.900636
H -1.401700 1.865983 0.709717
H -5.174833 -2.504824 -0.757065
H -6.189323 2.168974 0.687507
H -7.534991 -1.727791 -0.563269
H -8.035928 0.585085 0.150715
H -0.069827 1.036964 -1.366638
H 1.910266 -1.027159 -1.208244
H 4.598309 2.125820 -1.013630
H 3.308237 -1.493423 0.977631
H 6.984444 1.421519 -0.745907
H 5.688677 -2.192028 1.253095


%chk=000258829-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258829

0 1
Cl 8.492379 -1.013267 0.013994
O -0.390296 -1.802786 -0.005049
O 2.361030 2.077652 -0.079406
N 0.316791 0.377111 -0.050439
N 1.628774 -0.096301 -0.034861
C -4.504385 -0.622812 -0.027669
C -4.840599 0.786731 -0.072991
C -2.104428 -0.052158 -0.049742
C -3.128629 -1.008076 -0.017383
C -3.775616 1.748003 -0.106854
C -2.442208 1.345881 -0.095702
C -5.563053 -1.590936 0.006102
C -6.219992 1.173710 -0.082948
C -0.701291 -0.560252 -0.033802
C -6.899055 -1.184733 -0.004273
C -7.229742 0.208059 -0.049148
C 4.053903 0.312491 -0.031786
C 2.651829 0.830642 -0.050115
C 5.092762 1.278078 -0.065077
C 4.392091 -1.066473 0.016917
C 6.445850 0.885868 -0.051611
C 5.741955 -1.474067 0.030997
C 6.749858 -0.489231 -0.004030
H -2.847722 -2.066738 0.016755
H -4.025977 2.814599 -0.142551
H -1.663174 2.116206 -0.124503
H -5.305954 -2.656034 0.040542
H -6.473622 2.239850 -0.117618
H -7.701741 -1.929419 0.021901
H -8.282027 0.512611 -0.056928
H 0.260098 1.400029 -0.070278
H 1.673967 -1.120964 -0.015038
H 4.813033 2.335534 -0.101463
H 3.623943 -1.847374 0.046580
H 7.246266 1.630385 -0.077454
H 6.005580 -2.534519 0.069033


