%chk=000269849.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269849

0 1
Cl 6.724278 2.306594 -1.338513
O -1.158292 1.261669 -0.492331
N -0.933601 -1.480487 0.433462
N 1.987169 -0.716167 0.585540
C -4.700016 0.641200 -0.032040
C -4.671078 -0.907623 -0.102898
C -3.498899 1.189771 -0.830122
C -2.180367 -0.809211 0.089934
C -3.335842 -1.505537 0.238055
C -2.173864 0.598533 -0.401953
C -0.273956 -0.892916 1.644254
C 0.007718 -1.548849 -0.735274
C -4.618462 1.104260 1.431279
C -6.007077 1.153241 -0.660440
C 0.918256 0.028081 1.327350
C 1.435902 -1.835464 -0.237657
C -3.388846 -2.910180 0.736099
C 3.049193 0.055927 0.044958
C 3.312127 1.367556 0.514027
C 3.956502 -0.531213 -0.874133
C 4.445250 2.056828 0.088897
C 5.087016 0.159447 -1.298252
C 5.321021 1.447594 -0.811712
H -4.950395 -1.240196 -1.126287
H -5.461519 -1.318474 0.557391
H -3.449615 2.295341 -0.748843
H -3.630641 0.994440 -1.914431
H 0.067191 -1.764799 2.250184
H -1.010001 -0.342006 2.264843
H 0.003959 -0.619938 -1.350315
H -0.348333 -2.377943 -1.383225
H -4.598395 2.197243 1.506264
H -5.476659 0.755653 2.014758
H -3.714514 0.730029 1.925287
H -6.062684 2.247598 -0.627797
H -6.105751 0.856413 -1.709491
H -6.885648 0.772782 -0.128283
H 0.555259 0.912162 0.742595
H 1.365464 0.401245 2.274670
H 1.444020 -2.741353 0.413878
H 2.094381 -2.065132 -1.104733
H -4.106273 -3.527323 0.182028
H -3.673955 -2.936321 1.798357
H -2.404964 -3.409882 0.670797
H 2.636769 1.856837 1.211126
H 3.775454 -1.538074 -1.249315
H 4.644318 3.064936 0.453763
H 5.782401 -0.298790 -2.001650


%chk=000269849-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269849

0 1
Cl 7.947562 0.739531 -0.206563
O -1.817215 1.817348 -0.565391
N -0.921614 -0.757268 0.248689
N 1.936094 -0.123903 -0.025773
C -5.162596 0.352020 0.158105
C -4.760034 -1.140111 -0.015623
C -4.172780 1.204785 -0.679780
C -2.318205 -0.458521 0.055284
C -3.285277 -1.432876 0.217797
C -2.700720 0.920185 -0.385501
C -0.181518 0.057726 1.255955
C -0.158241 -1.031359 -0.994639
C -5.095359 0.762420 1.652908
C -6.605065 0.565932 -0.361857
C 1.020780 0.818702 0.655195
C 1.320932 -1.301384 -0.668253
C -2.929470 -2.845575 0.607743
C 3.317902 0.079641 -0.068479
C 3.901727 1.332715 0.307509
C 4.205349 -0.961594 -0.494688
C 5.296422 1.529082 0.269831
C 5.599590 -0.761135 -0.540487
C 6.134952 0.481123 -0.154022
H -5.026245 -1.469287 -1.045099
H -5.364643 -1.774100 0.663828
H -4.349176 2.287759 -0.542147
H -4.331919 0.992332 -1.759476
H 0.183734 -0.604554 2.068618
H -0.866777 0.796685 1.708260
H -0.220401 -0.184160 -1.716173
H -0.580535 -1.927012 -1.489118
H -5.348806 1.832070 1.772551
H -5.816891 0.174822 2.250908
H -4.089217 0.602096 2.079545
H -6.909460 1.623672 -0.254789
H -6.693484 0.293579 -1.431017
H -7.326707 -0.050627 0.207005
H 0.646995 1.605134 -0.029602
H 1.560885 1.307258 1.487157
H 1.397433 -2.206747 -0.025117
H 1.848628 -1.520230 -1.617088
H -3.212824 -3.559262 -0.192218
H -3.493485 -3.152369 1.510423
H -1.848595 -2.929681 0.801415
H 3.267270 2.174057 0.599747
H 3.814423 -1.945824 -0.767463
H 5.720877 2.496549 0.554985
H 6.259705 -1.572143 -0.862994


