%chk=000232952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232952

0 1
Cl -8.046437 1.798569 1.675248
S -5.327760 -1.059203 -0.151249
O -3.107036 -0.233666 -1.770435
O -3.265102 1.085614 0.106339
N -1.807684 -0.749904 0.005613
C 1.438075 -0.785926 0.563838
C 0.396208 0.136075 0.717330
C 2.737114 -0.339238 0.139128
C 0.606098 1.518456 0.453800
C 3.817325 -1.317337 -0.030847
C 1.900104 1.955610 0.046642
C 2.942013 1.013585 -0.104546
C -0.971422 -0.332702 1.160624
C 3.570871 -2.684846 0.228774
C 1.250403 -2.206972 0.826653
C 2.250385 -3.101562 0.668707
C -0.434930 2.506071 0.579143
C 2.128473 3.353808 -0.210243
C 5.112155 -0.930556 -0.453529
C 4.606781 -3.634356 0.063271
C -0.188845 3.825816 0.325792
C 1.115986 4.260498 -0.073421
C 6.118573 -1.870161 -0.611509
C 5.865772 -3.231875 -0.352117
C -2.772999 0.133311 -0.471012
C -4.351858 0.312803 -2.286193
C -5.489440 -0.614976 -1.900464
C -5.954945 0.389040 0.744582
C -7.462446 0.366787 0.749106
H 3.925218 1.368605 -0.422453
H -1.504697 0.461612 1.742772
H -0.896759 -1.209889 1.849817
H 0.265437 -2.532960 1.168359
H 2.097990 -4.162635 0.868931
H -1.440511 2.180129 0.872500
H 3.126136 3.665738 -0.515257
H 5.316498 0.121987 -0.656704
H 4.405259 -4.685354 0.265868
H -1.373221 -1.394769 -0.657731
H -0.979251 4.570036 0.419837
H 1.276156 5.320464 -0.264074
H 7.111018 -1.561845 -0.937121
H 6.664308 -3.960847 -0.480067
H -4.484884 1.346352 -1.911156
H -4.155573 0.323791 -3.375602
H -6.473648 -0.169801 -2.128098
H -5.433974 -1.574022 -2.459021
H -5.532146 0.330096 1.772138
H -5.533365 1.329977 0.326500
H -7.876651 -0.532092 1.247478
H -7.902373 0.439965 -0.262841


%chk=000232952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232952

0 1
Cl -8.281470 2.385801 1.423523
S -6.118579 -1.369458 0.021711
O -3.417711 -0.434828 -1.621684
O -3.346523 0.955951 0.293687
N -1.703361 -0.662833 -0.152785
C 1.623578 -0.799755 0.478333
C 0.545688 0.124142 0.623296
C 2.959931 -0.325195 0.128160
C 0.753125 1.526071 0.397400
C 4.066078 -1.289079 -0.018157
C 2.088619 1.990973 0.057484
C 3.149474 1.055725 -0.061678
C -0.845107 -0.372080 1.014445
C 3.809699 -2.691989 0.173141
C 1.433726 -2.231918 0.651742
C 2.469858 -3.128590 0.505279
C -0.301646 2.506782 0.481914
C 2.320341 3.394433 -0.154848
C 5.398115 -0.896280 -0.347098
C 4.867415 -3.639356 0.033075
C -0.041967 3.859579 0.266703
C 1.280882 4.313997 -0.050106
C 6.428928 -1.840029 -0.481286
C 6.166253 -3.224710 -0.290654
C -2.857131 0.028815 -0.409812
C -4.713390 0.159993 -2.005888
C -5.862447 -0.825511 -1.774882
C -6.507779 0.274316 0.889762
C -7.905150 0.750334 0.520020
H 4.138465 1.448407 -0.319077
H -1.380068 0.380391 1.613306
H -0.777635 -1.275057 1.644325
H 0.440817 -2.618008 0.900109
H 2.293005 -4.202467 0.639945
H -1.328986 2.196825 0.698718
H 3.335266 3.726922 -0.403552
H 5.637882 0.160045 -0.500429
H 4.647016 -4.702928 0.183478
H -1.402552 -1.356986 -0.838778
H -0.859694 4.585291 0.335815
H 1.464722 5.381585 -0.212257
H 7.441403 -1.506626 -0.734026
H 6.973393 -3.957398 -0.396488
H -4.855118 1.104121 -1.451120
H -4.624241 0.378875 -3.085139
H -6.801361 -0.397422 -2.169438
H -5.669058 -1.774952 -2.302576
H -6.439295 0.032556 1.963126
H -5.713449 0.999061 0.651752
H -8.689203 0.050896 0.843201
H -8.014359 0.988872 -0.548593


