%chk=000258972.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258972

0 1
Cl 2.175492 -2.446617 0.737208
N -2.078175 0.580055 0.148097
N 0.747227 0.017222 -0.099249
N -4.211866 -2.014834 -0.826719
C -1.409722 0.496118 -1.194639
C -1.385791 -0.364505 1.089257
C -3.564910 0.383316 0.088264
C 0.059507 0.945559 -1.052241
C 0.084002 0.073188 1.245996
C -4.191677 1.432468 -0.849002
C -4.168999 0.531931 1.496916
C 2.180002 0.166809 -0.032346
C -3.929294 -0.970141 -0.427899
C 2.947495 -0.962616 0.327447
C 2.863714 1.348099 -0.377851
C 4.342274 -0.921382 0.347601
C 4.259629 1.388364 -0.367364
C 5.000983 0.260509 -0.003302
H -1.924999 1.174684 -1.907113
H -1.448029 -0.530615 -1.624896
H -1.426653 -1.421036 0.738547
H -1.880162 -0.324436 2.083060
H 0.095102 2.008119 -0.725306
H 0.563277 0.874323 -2.040820
H 0.602989 -0.619324 1.942914
H 0.132451 1.091417 1.691631
H -3.893661 1.294867 -1.895317
H -5.286764 1.393048 -0.815873
H -3.885437 2.444573 -0.550240
H -3.858224 -0.271098 2.176072
H -5.264773 0.522113 1.463862
H -3.857878 1.483862 1.949146
H 2.306785 2.242545 -0.650410
H 4.911638 -1.808673 0.627587
H 4.773255 2.309678 -0.641296
H 6.088595 0.298413 0.005680


%chk=000258972-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258972

0 1
Cl 2.094258 -2.398636 1.127368
N -2.111542 0.599350 0.183260
N 0.769728 0.234667 0.016499
N -3.967665 -2.081159 -1.068978
C -1.385362 0.651771 -1.118972
C -1.391370 -0.327187 1.107623
C -3.586036 0.342079 0.061947
C 0.064013 1.132097 -0.917398
C 0.054540 0.149607 1.314535
C -4.256113 1.431635 -0.822506
C -4.260432 0.368260 1.462792
C 2.186042 0.205112 -0.006178
C -3.842846 -1.005085 -0.564957
C 2.941426 -0.899022 0.493350
C 2.945140 1.268342 -0.585839
C 4.345803 -0.935545 0.461393
C 4.352767 1.233093 -0.648685
C 5.065353 0.137763 -0.112959
H -1.887297 1.365657 -1.791907
H -1.367376 -0.348068 -1.613857
H -1.378270 -1.370365 0.713628
H -1.892560 -0.327979 2.088569
H 0.044039 2.183972 -0.544521
H 0.577673 1.117456 -1.894734
H 0.574652 -0.551767 1.983579
H 0.037810 1.152904 1.799875
H -3.953433 1.369291 -1.879978
H -5.352673 1.319122 -0.785213
H -3.981819 2.424548 -0.425348
H -3.973842 -0.490197 2.090943
H -5.356891 0.342734 1.347017
H -3.974734 1.303712 1.975067
H 2.414849 2.143854 -0.973158
H 4.868671 -1.811922 0.856266
H 4.892288 2.071661 -1.102568
H 6.158615 0.104242 -0.148553


