%chk=000218743.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218743

0 1
Cl 8.799888 0.673237 -0.554511
S -6.679000 -0.234869 1.308952
S -7.420217 -0.073046 -0.603146
O 3.241544 -0.890635 -0.164420
O -6.398373 -1.191126 -1.327951
O -8.721808 -0.646684 -0.668691
O -7.081534 1.197711 -1.143805
N -2.724369 0.370105 0.574804
N 4.849780 0.829175 -0.166501
C -0.281113 0.261553 0.251931
C -1.581869 -0.556847 0.303129
C 0.931019 -0.656566 0.073481
C 2.218865 0.158621 0.027732
C -4.034357 -0.353649 0.594638
C -5.068205 0.605890 1.180096
C 4.536772 -0.497408 -0.252384
C 5.487929 -1.535031 -0.433070
C 6.821941 -1.168130 -0.527524
C 6.164420 1.164794 -0.261752
C 7.159452 0.194085 -0.440773
H -0.325142 1.002033 -0.570572
H -0.183276 0.854279 1.185924
H -1.532389 -1.293059 1.137063
H -1.706416 -1.141560 -0.634078
H 0.837805 -1.258805 -0.853555
H 0.988060 -1.397097 0.897995
H -2.751167 1.106194 -0.141283
H 2.275729 0.854830 -0.825435
H 2.443273 0.689597 0.967870
H -4.349898 -0.720085 -0.411697
H -3.937535 -1.257336 1.239740
H -5.155703 1.543088 0.591323
H -4.783013 0.917027 2.209987
H 5.159319 -2.569406 -0.491818
H 7.602111 -1.919477 -0.666880
H 6.402989 2.233969 -0.190996
H -6.803113 -1.841672 -1.925924


%chk=000218743-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218743

0 1
Cl 8.953402 1.208069 -0.506782
S -6.644627 -0.242372 1.572760
S -7.720098 0.336224 -0.582680
O 3.445458 -1.005838 -0.108649
O -7.698329 -1.380201 -1.299555
O -9.264258 0.812305 -0.517271
O -6.656927 1.241779 -1.413464
N -2.692352 0.069292 0.399112
N 4.895180 0.867350 -0.196776
C -0.212150 0.024226 0.192207
C -1.509410 -0.802993 0.283777
C 1.041434 -0.872718 0.077661
C 2.320165 -0.037985 -0.005425
C -3.992337 -0.572474 0.636129
C -4.990359 0.498422 1.111914
C 4.723681 -0.479396 -0.201979
C 5.796327 -1.408205 -0.298852
C 7.102102 -0.898987 -0.393540
C 6.166816 1.356675 -0.288884
C 7.280453 0.504813 -0.387629
H -0.266911 0.698410 -0.688565
H -0.142776 0.672823 1.086821
H -1.475419 -1.449163 1.183311
H -1.574385 -1.488009 -0.597450
H 0.970960 -1.516084 -0.820455
H 1.106608 -1.546390 0.953655
H -2.724449 0.813674 -0.309715
H 2.333341 0.623532 -0.891797
H 2.469445 0.591447 0.891679
H -4.413550 -1.094210 -0.254486
H -3.858799 -1.337343 1.424774
H -5.182562 1.238217 0.306649
H -4.618753 1.045562 1.998117
H 5.592663 -2.481525 -0.298134
H 7.962025 -1.570180 -0.469970
H 6.281576 2.445177 -0.282740
H -8.400791 -1.410226 -2.015867


