%chk=000218311.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218311

0 1
Cl 5.432884 1.313417 1.965863
Cl 2.042367 -3.593501 -1.576829
O -0.789281 0.373382 -1.988890
N 2.232726 0.185522 -0.200507
N 0.010005 1.119975 0.020543
C 1.363236 1.357273 -0.540768
C 3.645446 0.575408 0.088938
C 2.125845 -0.926427 -1.194166
C 3.742097 0.848081 1.592436
C 2.157016 -2.238300 -0.407665
C -0.978427 0.528587 -0.793993
C -2.252265 0.176657 -0.092581
C -2.817174 -1.083615 -0.333796
C -2.891151 1.088973 0.757261
C -4.013508 -1.437391 0.295862
C -4.090460 0.730937 1.379208
C -4.648656 -0.531877 1.152367
H 1.272197 1.537424 -1.642815
H 1.767301 2.285400 -0.069108
H 3.987012 1.460641 -0.492072
H 4.343084 -0.249142 -0.185798
H 2.928198 -0.909354 -1.963547
H 1.164884 -0.848099 -1.764151
H -0.018274 0.961331 1.027313
H 3.492764 -0.048796 2.190373
H 3.084012 1.673452 1.917881
H 1.305077 -2.318644 0.292869
H 3.091844 -2.366524 0.167330
H -2.326393 -1.777692 -1.019367
H -2.463405 2.077944 0.923508
H -4.453840 -2.416942 0.112958
H -4.592626 1.438040 2.037925
H -5.583134 -0.808740 1.640018


%chk=000218311-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218311

0 1
Cl 3.686466 0.916170 3.202837
Cl 3.064755 -3.476077 -2.126112
O -0.670010 -0.811212 -1.612692
N 2.494529 0.424376 -0.761927
N 0.083678 1.035140 -0.426239
C 1.333876 1.172642 -1.219958
C 3.217024 0.889644 0.424059
C 2.983601 -0.741166 -1.514324
C 2.788329 0.154398 1.712796
C 2.271005 -2.058072 -1.142806
C -0.860551 0.053476 -0.696145
C -2.105547 0.046422 0.153606
C -2.878440 -1.143165 0.164033
C -2.542422 1.163178 0.914823
C -4.052617 -1.225539 0.940024
C -3.720739 1.081593 1.688262
C -4.474823 -0.114763 1.708361
H 1.091071 0.841964 -2.243761
H 1.566613 2.257152 -1.231728
H 3.034754 1.974590 0.560087
H 4.308481 0.759571 0.287784
H 4.069540 -0.850826 -1.330081
H 2.855588 -0.571003 -2.600758
H -0.059242 1.665084 0.364277
H 3.077924 -0.906912 1.711136
H 1.713679 0.261631 1.922044
H 1.208820 -2.046395 -1.425859
H 2.403073 -2.328718 -0.084120
H -2.538769 -1.983765 -0.449729
H -1.998319 2.115580 0.886485
H -4.639055 -2.150595 0.945675
H -4.054868 1.950045 2.266146
H -5.388004 -0.177049 2.310404


