%chk=000246798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246798

0 1
Cl -5.619119 0.304607 -0.210788
O -1.623954 -1.696109 -0.357381
N -0.448028 0.185691 0.262406
C 1.911629 1.892946 0.023444
C 0.776689 2.283525 0.986390
C -0.551910 1.647449 0.575503
C 2.010360 0.385679 0.009466
C 0.857363 -0.422882 0.161323
C 1.704101 2.441008 -1.391664
C 3.264616 -0.220075 -0.121417
C -1.632605 -0.516293 -0.051128
C 1.001954 -1.821849 0.224363
C -2.936572 0.265080 0.019333
C 3.397464 -1.609873 -0.087026
C 2.263200 -2.404407 0.095037
C -4.106985 -0.658095 -0.291502
H 2.865477 2.322219 0.426760
H 0.660816 3.383390 1.024135
H 1.050118 1.968558 2.014544
H -1.287920 1.778679 1.403337
H -0.950271 2.176206 -0.322688
H 2.564547 2.206631 -2.030616
H 0.824767 1.998539 -1.874588
H 1.576534 3.527755 -1.389767
H 4.150021 0.401303 -0.252177
H 0.129122 -2.469505 0.359238
H -2.922242 1.113665 -0.699402
H -3.069587 0.721642 1.024778
H 4.377200 -2.068356 -0.196843
H 2.357209 -3.489309 0.135851
H -4.188404 -1.489101 0.436394
H -4.032092 -1.099519 -1.305214


%chk=000246798-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246798

0 1
Cl -5.709476 0.398088 -0.184302
O -1.671875 -1.733078 -0.416733
N -0.432149 0.171289 0.242950
C 1.901215 1.897263 -0.020384
C 0.788913 2.268692 0.985241
C -0.545620 1.628876 0.582274
C 2.035071 0.380759 0.006627
C 0.877539 -0.445707 0.153681
C 1.633639 2.440366 -1.450192
C 3.309645 -0.223088 -0.074702
C -1.622667 -0.515467 -0.053441
C 1.041152 -1.857538 0.225842
C -2.935417 0.277531 0.075969
C 3.470353 -1.623055 -0.022600
C 2.324779 -2.432942 0.134133
C -4.112741 -0.607694 -0.340466
H 2.854272 2.337468 0.331927
H 0.638998 3.363873 1.032048
H 1.085695 1.928033 1.994898
H -1.267724 1.748934 1.409907
H -0.956453 2.168391 -0.292942
H 2.482035 2.203283 -2.115831
H 0.731556 1.988599 -1.899883
H 1.503431 3.538855 -1.435536
H 4.188279 0.426112 -0.176417
H 0.166243 -2.497812 0.326058
H -2.917370 1.188174 -0.551998
H -3.083532 0.620842 1.118182
H 4.467030 -2.071060 -0.093093
H 2.421830 -3.522893 0.187346
H -4.238570 -1.481379 0.311230
H -4.054582 -0.924514 -1.389692


