%chk=000222645.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222645

0 1
Cl 6.127605 -0.286324 -3.028449
O 2.690970 0.256044 1.694478
O 0.396678 -0.847733 0.706469
O -5.979452 -1.702706 -1.537709
O -6.911850 0.297014 -1.185867
N -0.817577 1.102568 0.928514
C 3.762981 -1.129962 0.081778
C 3.431696 0.178964 0.507942
C -2.073889 0.670454 0.407809
C 1.524347 1.087483 1.665441
C 4.614788 -1.255039 -1.022521
C 3.907469 1.324940 -0.134710
C 0.355719 0.309679 1.046932
C 3.217310 -2.315111 0.792858
C -3.123254 1.620283 0.389407
C -2.286624 -0.634772 -0.072391
C -4.585260 -0.050299 -0.587438
C 4.748416 1.181379 -1.242470
C 5.086916 -0.105444 -1.662999
C -4.368703 1.254546 -0.106806
C -3.538870 -0.987933 -0.566789
C -5.918991 -0.392460 -1.102736
H 1.718510 2.042681 1.146883
H 1.349996 1.268954 2.748339
H 3.643103 2.315472 0.227329
H 4.901275 -2.243173 -1.385214
H -0.786079 2.077392 1.237520
H 3.325400 -3.247320 0.226876
H 3.704959 -2.453546 1.769433
H 2.136199 -2.175931 1.002179
H -2.968442 2.631522 0.757920
H -1.475506 -1.372220 -0.060680
H 5.134702 2.057369 -1.762254
H -5.191128 1.977528 -0.127995
H -3.716491 -2.001187 -0.943774
H -6.880524 -1.937810 -1.887709


%chk=000222645-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222645

0 1
Cl 5.712543 -0.011169 -3.418857
O 2.592032 -0.364081 1.727121
O 0.130388 -1.377973 0.711744
O -6.385427 -0.959856 -1.891371
O -6.911542 1.246670 -1.389695
N -0.852619 0.748994 0.957852
C 4.442797 -1.015059 0.371284
C 3.253135 -0.238533 0.483591
C -2.135774 0.569837 0.370724
C 1.366014 0.377323 1.934484
C 5.178414 -0.927975 -0.831391
C 2.810956 0.589212 -0.572149
C 0.171131 -0.190733 1.123429
C 4.882918 -1.908151 1.511236
C -3.013808 1.690774 0.371921
C -2.557967 -0.660283 -0.204839
C -4.722108 0.362810 -0.768292
C 3.559020 0.664654 -1.770342
C 4.734248 -0.094610 -1.878128
C -4.293174 1.587764 -0.192572
C -3.844716 -0.751423 -0.766868
C -6.083355 0.302640 -1.353666
H 1.512048 1.460213 1.728846
H 1.149870 0.252046 3.010378
H 1.884444 1.166399 -0.499659
H 6.094979 -1.514316 -0.947388
H -0.670705 1.689191 1.321415
H 5.815053 -2.441450 1.260720
H 5.047585 -1.323547 2.434738
H 4.101679 -2.652756 1.749103
H -2.690358 2.640502 0.817022
H -1.880201 -1.514948 -0.207025
H 3.222929 1.297727 -2.596030
H -4.978300 2.441394 -0.198971
H -4.179537 -1.692016 -1.212673
H -7.306193 -0.933970 -2.266097


