%chk=000239792.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239792

0 1
Cl 0.324758 -1.573132 0.604971
S -5.015102 0.985838 -0.022800
O 3.247088 1.535804 -2.059808
O 2.823713 -2.006760 1.936717
O -5.700488 1.832493 -0.970212
O -5.162211 1.279081 1.411003
N 0.757767 0.789084 -1.399894
N -5.532626 -0.615082 -0.224641
N -6.415893 -2.719229 0.347485
N -6.854565 -0.864193 1.796556
C 4.315049 0.548266 -0.173223
C 1.811573 0.272330 -0.655219
C 4.198606 -0.397328 0.863008
C 3.165629 0.858568 -1.057848
C -0.618917 0.792389 -1.027280
C 1.750049 -0.702333 0.288677
C 2.908879 -1.127334 1.109786
C -3.335986 0.915792 -0.409958
C 5.532364 1.204528 -0.388154
C -1.574557 0.711777 -2.062583
C -1.020473 0.959369 0.311969
C 5.298718 -0.675468 1.676488
C -2.929234 0.770785 -1.741344
C -2.382209 1.012115 0.608755
C 6.631921 0.924814 0.434783
C 6.515527 -0.010941 1.462810
C -6.235191 -1.334914 0.621061
H 1.003545 1.238040 -2.294725
H -1.265771 0.588478 -3.098650
H -0.284429 1.063149 1.108658
H 5.617576 1.932449 -1.200917
H 5.201492 -1.416760 2.477238
H -3.676218 0.704383 -2.541096
H -2.704459 1.142343 1.650742
H 7.578304 1.440624 0.266240
H 7.370867 -0.231497 2.103761
H -6.096060 -3.008760 -0.576580
H -7.321878 -3.112968 0.571961
H -7.103677 -1.523755 2.520048
H -6.522081 0.043054 2.169414


%chk=000239792-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239792

0 1
Cl 0.643291 -2.024794 0.628575
S -5.148912 0.821249 -0.144548
O 3.108662 1.853176 -1.760270
O 3.301570 -2.165993 1.970901
O -5.811142 1.578014 -1.424540
O -5.372237 1.466924 1.369763
N 0.835592 0.692478 -1.173178
N -5.552976 -0.981868 -0.151165
N -7.131153 -2.593735 0.378939
N -7.226110 -0.571641 1.589632
C 4.441708 0.657512 -0.132235
C 1.923572 0.214944 -0.469564
C 4.464871 -0.370935 0.849812
C 3.185651 0.972093 -0.842973
C -0.555495 0.653124 -0.890879
C 2.013923 -0.867456 0.401795
C 3.245181 -1.204960 1.138797
C -3.300998 0.734632 -0.437230
C 5.616046 1.397252 -0.418508
C -1.453818 0.787863 -1.984531
C -1.054533 0.592232 0.438840
C 5.664407 -0.647647 1.542382
C -2.842651 0.831965 -1.760895
C -2.443714 0.625757 0.668305
C 6.809192 1.117620 0.278352
C 6.831849 0.095910 1.260127
C -6.623640 -1.325020 0.609955
H 1.133650 1.337742 -1.924142
H -1.061345 0.841561 -3.005833
H -0.365481 0.547246 1.285415
H 5.569015 2.182796 -1.179057
H 5.659413 -1.449602 2.286736
H -3.555180 0.949124 -2.583142
H -2.851123 0.603753 1.683559
H 7.716961 1.690324 0.062835
H 7.759372 -0.121163 1.800372
H -6.756059 -3.100715 -0.420598
H -7.580279 -3.118359 1.127487
H -8.160915 -0.801132 1.920081
H -6.774764 0.324831 1.847825


