%chk=000219770.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219770

0 1
Cl -7.374675 -0.017516 -1.403341
O 5.880215 0.815561 0.421885
N -1.720112 0.546803 0.307641
N 2.834390 0.093443 1.456585
N -1.276652 1.743218 0.848430
N -0.640530 -1.673888 -0.196544
N 1.731768 -1.734670 0.391993
C 0.490009 0.301410 0.801048
C -0.661654 -0.377029 0.259337
C 1.705010 -0.440167 0.862575
C -3.091048 0.400175 -0.109607
C 4.147354 -0.593706 1.381265
C 0.028163 1.617756 1.148183
C 4.911384 -0.180078 0.178505
C -3.558106 -0.842172 -0.574448
C -3.952434 1.515411 -0.043997
C 0.570290 -2.277436 -0.097886
C 4.909872 -0.524946 -1.147920
C -4.889216 -0.968221 -0.976178
C -5.280472 1.383142 -0.445180
C -5.731788 0.142899 -0.906683
C 5.922031 0.279236 -1.788883
C 6.480100 1.066043 -0.816129
H 3.996497 -1.707590 1.373349
H 4.714480 -0.352023 2.314704
H 2.872840 1.101776 1.596223
H 0.602772 2.418904 1.587686
H -2.897385 -1.715483 -0.629882
H -3.585623 2.479617 0.320112
H 0.640750 -3.320600 -0.453945
H 4.284369 -1.251469 -1.634573
H -5.262832 -1.926909 -1.339616
H -5.957579 2.237308 -0.399327
H 6.168178 0.243748 -2.833024
H 7.246435 1.806856 -0.768056


%chk=000219770-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219770

0 1
Cl -7.641768 0.008954 -1.188334
O 5.718244 1.020848 0.422483
N -1.784197 0.553714 0.254157
N 2.823968 0.066694 1.170498
N -1.321086 1.808172 0.703572
N -0.797432 -1.696078 -0.143999
N 1.601584 -1.786860 0.366995
C 0.426099 0.308200 0.682171
C -0.746362 -0.378112 0.229945
C 1.633519 -0.465566 0.740365
C -3.166936 0.409262 -0.091649
C 4.097281 -0.688206 1.179925
C -0.000160 1.648685 0.956021
C 5.069388 -0.210339 0.144966
C -3.668663 -0.836120 -0.547290
C -4.024981 1.530619 0.029816
C 0.409765 -2.316083 -0.044115
C 5.495404 -0.681296 -1.085243
C -5.034295 -0.955409 -0.880843
C -5.388397 1.407989 -0.304588
C -5.875501 0.165818 -0.755803
C 6.449558 0.276626 -1.609847
C 6.556496 1.291122 -0.675649
H 3.838283 -1.740666 0.986433
H 4.548158 -0.613162 2.187266
H 2.860515 1.060746 1.398637
H 0.566818 2.504922 1.318967
H -2.994560 -1.691629 -0.635451
H -3.618672 2.480545 0.382749
H 0.434043 -3.372103 -0.329462
H 5.163665 -1.601703 -1.561651
H -5.431734 -1.911653 -1.232615
H -6.058484 2.267410 -0.214329
H 6.983551 0.214756 -2.555874
H 7.133685 2.209308 -0.613922


