%chk=000234786.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234786

0 1
Cl -9.711648 0.006515 0.502222
Cl 9.711591 -0.006213 0.502298
S -3.588682 -0.004895 -0.685934
S 3.588634 0.004138 -0.685915
O -3.269540 -1.269788 -1.315246
O -3.266572 1.255668 -1.322356
O 3.269594 1.268251 -1.316841
O 3.266430 -1.257212 -1.320731
C -2.899395 -0.001575 0.953337
C 2.899335 0.002929 0.953354
C -1.405237 -0.000393 0.895963
C 1.405178 0.001727 0.895972
C -0.698676 1.212811 0.876151
C 0.696778 1.213863 0.876177
C -0.696834 -1.212546 0.876913
C 0.698615 -1.211494 0.876896
C -5.301913 -0.001760 -0.345425
C 5.301862 0.001306 -0.345390
C -5.985506 1.212407 -0.238935
C 5.985360 -1.212774 -0.237326
C -5.987895 -1.213529 -0.227679
C 5.987938 1.213174 -0.229205
C -7.357864 1.225887 0.027804
C 7.357716 -1.226016 0.029440
C -7.360269 -1.221828 0.039182
C 7.360310 1.221712 0.037654
C -8.020455 0.003303 0.166701
C 8.020401 -0.003306 0.166761
H -3.256289 -0.874353 1.539192
H -3.257949 0.872178 1.536668
H 3.256278 0.876420 1.538114
H 3.257832 -0.870113 1.537787
H -1.236896 2.160316 0.838919
H 1.233592 2.162187 0.838972
H -1.233656 -2.160892 0.840261
H 1.236844 -2.159021 0.840226
H -5.451474 2.160429 -0.378538
H 5.451256 -2.160935 -0.375706
H -5.455836 -2.163856 -0.358558
H 5.455952 2.163372 -0.361315
H -7.900468 2.167211 0.114517
H 7.900246 -2.167269 0.117373
H -7.904734 -2.161225 0.134642
H 7.904847 2.161189 0.131903


%chk=000234786-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234786

0 1
Cl -10.049719 0.008539 -0.030908
Cl 10.049673 -0.004005 -0.030827
S -3.604505 -0.006789 -0.613411
S 3.604452 0.004445 -0.613397
O -3.198898 -1.450069 -1.270212
O -3.193353 1.428655 -1.283625
O 3.197557 1.446328 -1.272454
O 3.194596 -1.432417 -1.281373
C -2.904897 0.000052 1.293026
C 2.904834 -0.000096 1.293044
C -1.423215 -0.000024 1.272908
C 1.423152 -0.000098 1.272917
C -0.702784 1.226476 1.247917
C 0.702813 1.226475 1.248097
C -0.702877 -1.226626 1.249392
C 0.702722 -1.226628 1.249220
C -5.491819 -0.002194 -0.411412
C 5.491768 0.001895 -0.411377
C -6.152284 1.237172 -0.376779
C 6.153387 -1.236798 -0.374741
C -6.157118 -1.238565 -0.364362
C 6.155915 1.238959 -0.366316
C -7.560868 1.239596 -0.258278
C 7.561972 -1.237719 -0.256227
C -7.565697 -1.234310 -0.245841
C 7.564496 1.236207 -0.247781
C -8.238348 0.004290 -0.186040
C 8.238300 -0.001669 -0.185978
H -3.372708 -0.913494 1.688678
H -3.372554 0.916169 1.682868
H 3.372564 0.913965 1.687602
H 3.372567 -0.915703 1.683988
H -1.250708 2.174416 1.220600
H 1.250826 2.174353 1.220785
H -1.250896 -2.174529 1.223075
H 1.250652 -2.174591 1.222903
H -5.587413 2.170242 -0.474451
H 5.589387 -2.170551 -0.470907
H -5.595907 -2.174773 -0.452656
H 5.593832 2.174499 -0.456129
H -8.117971 2.180013 -0.231295
H 8.119950 -2.177571 -0.227720
H -8.126454 -2.172226 -0.209385
H 8.124380 2.174703 -0.212839


