%chk=000236278.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236278

0 1
Cl -3.471659 -2.657449 0.000348
O -2.882065 2.407831 0.000469
O -0.804850 2.989538 -0.000778
N 1.096528 1.108883 0.000138
N 1.540165 -1.693376 -0.000017
N -1.681597 2.158007 -0.000051
C 0.014439 0.232337 0.000069
C 0.242710 -1.179338 0.000030
C 2.326461 0.611562 0.000081
C 2.558443 -0.843881 0.000017
C -1.338066 0.704667 0.000061
C -0.849883 -2.095574 0.000099
C -2.389739 -0.193933 0.000139
C -2.129019 -1.588493 0.000212
C 3.469114 1.565677 0.000158
C 3.943083 -1.391920 0.000037
H -0.644148 -3.171260 0.000045
H -3.431156 0.166612 0.000085
H 4.102247 1.438985 0.890686
H 4.103338 1.437922 -0.889428
H 3.122324 2.616889 -0.000639
H 4.504504 -1.067796 0.889245
H 3.948575 -2.496567 0.000046
H 4.504549 -1.067823 -0.889152


%chk=000236278-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236278

0 1
Cl -3.560942 -2.731271 0.063639
O -2.615059 2.565679 0.638947
O -0.997351 2.857578 -0.950769
N 1.080216 1.123475 0.039619
N 1.539176 -1.704587 -0.035902
N -1.659354 2.135847 -0.120233
C 0.022372 0.234655 -0.027070
C 0.246473 -1.194027 -0.021082
C 2.327604 0.614018 0.050707
C 2.562737 -0.827719 -0.022361
C -1.338084 0.688650 -0.042617
C -0.851082 -2.105864 -0.001314
C -2.413904 -0.199891 0.010122
C -2.147276 -1.595689 0.023228
C 3.475424 1.587053 0.150786
C 3.963016 -1.386584 -0.068420
H -0.642579 -3.178518 -0.003243
H -3.437843 0.181504 0.034848
H 4.089316 1.397419 1.051634
H 4.151589 1.503582 -0.721092
H 3.079874 2.612581 0.195938
H 4.551509 -1.075600 0.815193
H 3.918154 -2.485499 -0.099088
H 4.510312 -1.025291 -0.959569


