%chk=000245753.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245753

0 1
Cl -6.038426 -0.563986 -0.720493
S -0.490984 1.996928 0.543656
N 1.301150 -0.064195 0.959322
C 2.446282 0.618101 0.369589
C 0.821965 -1.263457 0.351468
C 0.388361 0.822452 1.673290
C 2.416751 1.121971 -0.941118
C 1.642655 -1.967400 -0.558820
C 3.591056 0.761591 1.170115
C -0.420135 -1.815935 0.732160
C -2.037056 1.217379 0.224032
C 3.543914 1.774078 -1.445706
C 1.218386 -3.192231 -1.070009
C 4.709250 1.417444 0.649221
C -0.823855 -3.044074 0.208143
C 4.688138 1.923465 -0.654458
C -0.014733 -3.737257 -0.696012
C -3.147982 1.594074 0.983493
C -2.145297 0.302034 -0.826551
C -4.399305 1.041311 0.691507
C -3.392326 -0.256834 -1.124371
C -4.497154 0.124100 -0.358183
H 0.967328 1.476411 2.367109
H -0.348759 0.245365 2.271896
H 1.522179 1.009994 -1.553685
H 2.611558 -1.569885 -0.855129
H 3.606068 0.357845 2.181518
H -1.067812 -1.299384 1.437085
H 3.528149 2.171594 -2.460071
H 1.857945 -3.730723 -1.769685
H 5.601802 1.532442 1.263156
H -1.783772 -3.463969 0.509655
H 5.562310 2.434480 -1.053842
H -0.337223 -4.691907 -1.101098
H -3.049585 2.316955 1.795751
H -1.266756 0.013033 -1.408892
H -5.279838 1.321606 1.268770
H -3.499052 -0.974918 -1.937312


%chk=000245753-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245753

0 1
Cl -6.809826 -0.235604 0.583640
S -0.752377 1.879118 -0.269412
N 1.308134 -0.003371 0.534951
C 2.587612 0.614022 0.254008
C 1.005466 -1.307655 0.030511
C 0.284683 0.830770 1.085627
C 3.078341 0.682285 -1.075029
C 2.058336 -2.234737 -0.217680
C 3.337857 1.191208 1.308891
C -0.338217 -1.727214 -0.171693
C -2.452689 1.248260 0.006576
C 4.309989 1.318088 -1.340072
C 1.768231 -3.541384 -0.656933
C 4.562793 1.838946 1.035088
C -0.614412 -3.043245 -0.601979
C 5.055577 1.902706 -0.288780
C 0.430322 -3.960266 -0.851637
C -3.079668 1.344643 1.275367
C -3.173671 0.701284 -1.085960
C -4.402456 0.881508 1.460758
C -4.504900 0.258053 -0.919024
C -5.095791 0.348375 0.356925
H 0.725379 1.617512 1.710229
H -0.479080 0.260889 1.636319
H 2.490419 0.244154 -1.887826
H 3.097626 -1.935094 -0.051893
H 2.972677 1.111939 2.339171
H -1.168767 -1.033015 -0.021981
H 4.679888 1.370630 -2.370016
H 2.593759 -4.239515 -0.836537
H 5.137608 2.280170 1.856817
H -1.657293 -3.345004 -0.751967
H 6.008060 2.400932 -0.499023
H 0.209431 -4.978030 -1.189739
H -2.548318 1.804152 2.115630
H -2.690376 0.617463 -2.064552
H -4.886159 0.954050 2.439167
H -5.062992 -0.158525 -1.762439


