%chk=000269164.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269164

0 1
Cl -4.832228 0.300227 -0.000452
N -2.359753 1.188670 -0.000117
C -0.348788 -0.258665 0.000005
C 1.114788 -0.272959 0.000040
C 1.822097 0.961038 0.000206
C -0.990763 1.017446 -0.000004
C -1.216505 -1.399529 -0.000041
C 1.113920 2.223311 0.000228
C -0.237248 2.256377 0.000088
C 1.901027 -1.455670 -0.000142
C 3.240951 0.986514 0.000303
C -2.598909 -1.219510 -0.000168
C -0.748122 -2.815658 0.000096
C 3.284459 -1.418416 -0.000059
C 3.969224 -0.186592 0.000187
C -3.119556 0.089497 -0.000210
H 1.703082 3.141932 0.000317
H -0.807089 3.189504 0.000043
H 1.427343 -2.435099 -0.000413
H 3.752599 1.949317 0.000440
H -3.278164 -2.071038 -0.000233
H -1.575400 -3.540322 -0.000341
H -0.137364 -3.037336 -0.891123
H -0.138259 -3.037399 0.891910
H 3.855219 -2.346793 -0.000207
H 5.057341 -0.169745 0.000248


%chk=000269164-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269164

0 1
Cl -4.942538 0.331843 -0.000129
N -2.376713 1.199909 -0.000026
C -0.342955 -0.265265 0.000034
C 1.132411 -0.278759 0.000102
C 1.847078 0.986172 0.000120
C -1.002388 1.031536 0.000033
C -1.222873 -1.422946 -0.000084
C 1.129534 2.237672 0.000101
C -0.248199 2.259445 0.000067
C 1.942146 -1.463749 0.000144
C 3.276213 1.014520 0.000170
C -2.616734 -1.209438 -0.000144
C -0.786648 -2.879241 -0.000194
C 3.344859 -1.411863 0.000198
C 4.027863 -0.165090 0.000206
C -3.127010 0.109906 -0.000091
H 1.705262 3.170590 0.000120
H -0.826745 3.186906 0.000062
H 1.482827 -2.448071 0.000156
H 3.775895 1.990885 0.000184
H -3.304002 -2.060137 -0.000224
H -1.675515 -3.532359 -0.000500
H -0.187802 -3.131957 -0.894419
H -0.188210 -3.132206 0.894238
H 3.915360 -2.347634 0.000233
H 5.122786 -0.131570 0.000244


