%chk=000278059.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278059

0 1
Cl 3.974865 -0.271628 1.892605
S 8.507321 -0.121186 -1.349737
F 9.525615 -1.247023 -0.386828
O 8.877048 -0.379479 -2.891592
O 8.651590 1.323331 -0.663311
N -4.423125 0.988939 0.379754
N -4.639777 3.385158 1.102625
N -5.494165 2.611104 -1.054451
N -5.020671 0.481293 -1.834867
N -5.829307 4.785282 -0.337854
C -4.213845 2.048292 1.515791
C 0.457015 -2.908386 -0.769842
C -1.016372 -2.583085 -1.253873
C -3.824009 -0.341737 0.421376
C 1.604947 -1.860199 -0.720687
C -2.164855 -2.047783 -0.365519
C -5.053797 1.622382 2.746618
C -2.726380 2.103297 1.864438
C -2.658971 -0.697927 -0.349783
C 2.887534 -2.585619 -0.155333
C -4.991544 1.406943 -0.806797
C -4.470816 -1.336556 1.208710
C -2.837449 -3.012078 0.449180
C 4.253277 -1.926738 -0.385611
C -3.964231 -2.662552 1.235782
C -5.271505 3.553182 -0.038626
C 4.831963 -0.897201 0.428936
C 5.032335 -2.375731 -1.497876
C 6.832993 -0.834660 -0.974700
C 6.108989 -0.354083 0.141591
C 6.305220 -1.845449 -1.807704
H 0.390773 -3.392443 0.224970
H 0.818352 -3.683237 -1.477618
H -0.944909 -1.934186 -2.147823
H -1.384578 -3.561801 -1.617691
H 1.820579 -1.508310 -1.749676
H 1.329061 -0.962022 -0.141941
H -4.653755 0.706036 3.225971
H -6.108305 1.457244 2.453463
H -5.035743 2.441628 3.489887
H -2.132617 2.348866 0.965672
H -2.365478 1.149591 2.296528
H -2.578469 2.913426 2.599943
H -2.202166 0.062065 -0.995001
H 2.744903 -2.792823 0.921734
H 2.918877 -3.570129 -0.658011
H -5.370059 -1.072276 1.774451
H -2.481048 -4.052899 0.446428
H -4.471852 -3.427396 1.839221
H 4.616788 -3.159901 -2.140808
H -5.597249 0.780867 -2.626159
H -5.051851 -0.520400 -1.601078
H 6.528269 0.431737 0.777072
H 6.870905 -2.201637 -2.674806
H -5.507965 5.579260 0.226629
H -6.029357 4.962338 -1.328579


%chk=000278059-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278059

0 1
Cl 2.017152 -1.522556 2.214431
S 5.922291 1.823052 0.110616
F 7.418161 0.927004 0.753389
O 6.347468 2.398175 -1.327402
O 5.419351 2.764998 1.310206
N -3.313017 0.856004 0.144148
N -2.296288 3.115326 0.020745
N -4.601328 2.697728 -0.719188
N -5.505697 0.549668 -0.722455
N -3.533280 4.724761 -1.153218
C -2.304443 1.851812 0.770343
C -0.132949 -3.899919 -1.177207
C -1.579687 -3.526336 -1.613870
C -3.163707 -0.568576 0.311088
C 0.794198 -2.676935 -1.008012
C -2.329970 -2.724486 -0.558598
C -2.730868 2.113453 2.242706
C -0.886852 1.250111 0.712397
C -2.514503 -1.328036 -0.695710
C 2.213916 -3.093538 -0.525061
C -4.460218 1.399719 -0.419906
C -3.661100 -1.221162 1.468578
C -2.829864 -3.361448 0.609128
C 3.132543 -1.902499 -0.339928
C -3.491816 -2.617637 1.610246
C -3.430836 3.473732 -0.569391
C 3.129727 -1.103758 0.834390
C 4.020355 -1.515881 -1.381031
C 4.809673 0.333334 -0.073433
C 3.962466 0.018530 0.999623
C 4.871803 -0.398047 -1.269714
H -0.177139 -4.461308 -0.221749
H 0.298969 -4.589943 -1.930462
H -1.533356 -2.954884 -2.560791
H -2.128810 -4.463340 -1.831175
H 0.879750 -2.134705 -1.971357
H 0.353174 -1.969506 -0.281290
H -2.668314 1.191986 2.850425
H -3.762673 2.506534 2.277447
H -2.058605 2.870906 2.681627
H -0.599530 1.049746 -0.333989
H -0.799000 0.323643 1.306428
H -0.190198 2.002547 1.117100
H -2.151263 -0.805984 -1.588357
H 2.109342 -3.645837 0.427493
H 2.656904 -3.788288 -1.263628
H -4.173154 -0.637025 2.240586
H -2.705037 -4.444969 0.728275
H -3.879095 -3.123938 2.501521
H 4.043024 -2.114953 -2.297773
H -6.302114 0.958937 -1.203771
H -5.502748 -0.428735 -0.447931
H 3.944467 0.620789 1.912646
H 5.547587 -0.105663 -2.078521
H -2.748961 5.366770 -1.089820
H -4.372900 4.954327 -1.675651


