%chk=000276061.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276061

0 1
Cl 5.542413 3.114409 -0.771201
O 1.271753 2.360653 0.356801
O -4.377422 -0.389582 -0.472952
O -4.057487 1.368962 0.913175
O 3.973146 -0.991678 1.267952
N 0.208762 0.301241 0.274847
N 2.657998 0.512171 0.375326
N 2.877669 -0.535531 1.210250
C 0.363575 -1.103629 -0.100584
C -1.129586 0.796853 0.525654
C 1.338787 1.150886 0.349607
C 3.726275 1.169321 -0.446429
C 0.713382 -1.422697 -1.421207
C 0.145801 -2.100191 0.862091
C -1.227248 2.021429 1.355118
C -2.180549 0.117820 0.010455
C 0.852913 -2.767512 -1.773711
C 0.287683 -3.438885 0.487809
C 4.243063 2.428153 0.246982
C 0.641152 -3.772858 -0.824081
C -3.576032 0.483967 0.233548
C -5.824190 -0.185114 -0.412920
C -6.221076 0.957295 -1.324970
H 3.319759 1.412783 -1.453986
H 4.554591 0.434654 -0.601240
H 0.868152 -0.639021 -2.160945
H -0.123631 -1.834927 1.884263
H -0.867191 2.917672 0.813261
H -0.643917 1.965919 2.285037
H -2.277800 2.240500 1.647487
H -2.054824 -0.767279 -0.625648
H 1.125533 -3.032110 -2.795688
H 0.124133 -4.225248 1.225571
H 4.665176 2.217118 1.247523
H 3.445204 3.194995 0.358639
H 0.751823 -4.819466 -1.106948
H -6.112514 -0.008641 0.638738
H -6.185731 -1.169199 -0.762675
H -5.854224 1.919267 -0.935443
H -5.799843 0.834390 -2.330880
H -7.309777 1.034509 -1.422730


%chk=000276061-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276061

0 1
Cl 5.984175 2.921237 -0.278275
O 1.291348 2.388683 -0.360089
O -4.420856 -0.437819 -0.316008
O -4.043301 1.494980 0.946071
O 3.809842 -0.715239 1.736412
N 0.225239 0.328499 0.141065
N 2.609022 0.601054 0.349078
N 2.635562 -0.347168 1.416623
C 0.362963 -1.075370 -0.243291
C -1.078794 0.872530 0.412222
C 1.336834 1.187086 0.016752
C 3.853335 1.138487 -0.252597
C 0.693432 -1.388689 -1.581005
C 0.134611 -2.098745 0.703264
C -1.129092 2.170493 1.184192
C -2.185291 0.158914 0.009778
C 0.819239 -2.742148 -1.969513
C 0.246575 -3.447269 0.305015
C 4.392247 2.339014 0.544163
C 0.593223 -3.772390 -1.028824
C -3.582762 0.522438 0.286960
C -5.889077 -0.215788 -0.168022
C -6.410506 0.725323 -1.258856
H 3.629673 1.442096 -1.287188
H 4.595359 0.321384 -0.252653
H 0.840325 -0.582339 -2.308618
H -0.111312 -1.834580 1.735746
H -0.903078 3.028464 0.528638
H -0.378236 2.171291 1.994759
H -2.136281 2.305150 1.602984
H -2.067181 -0.764492 -0.562627
H 1.080864 -2.988136 -3.004086
H 0.077008 -4.243452 1.037380
H 4.665727 2.069186 1.573939
H 3.699212 3.190072 0.513649
H 0.685791 -4.821052 -1.330826
H -6.085293 0.193726 0.838626
H -6.314682 -1.228301 -0.258104
H -5.981230 1.734313 -1.141879
H -6.157890 0.342089 -2.262619
H -7.511043 0.807866 -1.186342


