%chk=000245649.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245649

0 1
Cl 3.215606 3.657323 -0.546625
O 0.747155 3.017370 0.715321
O -4.714652 -2.161049 0.428444
O -2.865473 -2.857021 -0.450162
N 0.309495 0.991618 -0.296058
N -3.556084 -2.002291 0.082331
C 3.452622 1.077366 0.190986
C 2.530124 2.014233 -0.592707
C 3.073137 -0.366712 0.003867
C 1.128655 2.095989 0.031354
C -1.031707 0.796996 0.155055
C 2.458328 -1.076883 1.045377
C 3.323695 -1.005857 -1.220379
C -1.616725 -0.462365 -0.078822
C -1.774218 1.812993 0.793790
C 2.091098 -2.412834 0.859498
C 2.954012 -2.341042 -1.400673
C -2.938370 -0.672778 0.327925
C 2.334030 -3.045634 -0.363380
C -3.088678 1.568720 1.186830
C -3.688687 0.325150 0.958461
H 4.507228 1.232926 -0.135550
H 3.456360 1.360778 1.267050
H 2.472319 1.718237 -1.669760
H 0.729071 0.195203 -0.792587
H 2.266962 -0.592074 2.002254
H 3.818674 -0.468286 -2.027491
H -1.064920 -1.273283 -0.564701
H -1.315952 2.793379 0.985122
H 1.614667 -2.962481 1.671724
H 3.152922 -2.835989 -2.351134
H 2.044511 -4.086288 -0.506540
H -3.659007 2.359250 1.680128
H -4.720801 0.130237 1.264050


%chk=000245649-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245649

0 1
Cl 1.881460 2.862696 -1.875345
O 0.986754 1.327179 1.246477
O -6.332617 -0.185660 -0.694747
O -4.891568 -0.254966 -2.460617
N -0.367691 0.793445 -0.598902
N -5.153540 -0.082010 -1.207291
C 3.401081 1.057066 -0.296993
C 2.028621 1.166421 -0.974427
C 3.697220 -0.389290 0.098544
C 0.845190 1.106628 0.010508
C -1.652521 0.690474 -0.002150
C 3.368168 -0.877414 1.389227
C 4.300463 -1.272796 -0.834904
C -2.738606 0.370234 -0.853792
C -1.882031 0.890072 1.389001
C 3.641834 -2.219137 1.739033
C 4.572192 -2.615089 -0.487436
C -4.026410 0.256453 -0.299255
C 4.242578 -3.092216 0.802643
C -3.189887 0.767005 1.904810
C -4.283942 0.448752 1.074771
H 4.161822 1.421442 -1.008974
H 3.405613 1.719617 0.584987
H 1.923871 0.438875 -1.797164
H -0.343383 0.680756 -1.616172
H 2.893293 -0.202922 2.110214
H 4.574296 -0.902839 -1.831561
H -2.610485 0.207870 -1.929207
H -1.040213 1.137730 2.037426
H 3.388034 -2.582117 2.741289
H 5.045506 -3.283477 -1.215452
H 4.455982 -4.131635 1.075976
H -3.353251 0.924246 2.975637
H -5.302438 0.349506 1.456844


