%chk=000239683.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239683

0 1
Cl 4.875949 2.270749 -2.723789
Cl -6.345852 0.175626 2.623309
Cl 2.890665 -3.864188 2.540639
S 1.752224 2.707371 -0.157760
S -3.557090 1.533689 0.018720
S 0.020044 -2.370207 0.057905
N 0.760400 0.224065 -0.049236
N -1.612503 -0.297553 0.030682
C 3.267330 1.689640 -0.147880
C 4.375288 2.681098 -0.080303
C -4.496751 -0.025174 0.153563
C -5.913487 0.378295 -0.055697
C 2.122245 -3.930001 -0.069511
C 1.841569 -2.469248 -0.012591
C 0.442967 1.548867 -0.085797
C -1.880621 1.036841 -0.006038
C -0.878282 2.018497 -0.066580
C -0.292314 -0.645732 0.008262
C 5.160911 3.017204 -1.193926
C 4.663481 3.317261 1.142124
C -6.830691 0.501450 0.999864
C -6.372638 0.649100 -1.358826
C 2.595792 -4.655062 1.035272
C 1.911234 -4.630492 -1.272394
C 6.198143 3.951656 -1.113568
C 5.694905 4.252625 1.235273
C -8.159575 0.880906 0.785350
C -7.695691 1.030101 -1.585937
C 2.852927 -6.027823 0.964994
C 2.162636 -6.000691 -1.355198
C 6.462777 4.571635 0.109024
C -8.590437 1.147085 -0.515570
C 2.632688 -6.701183 -0.238021
H 3.262346 1.000440 0.723714
H 3.293503 1.030322 -1.039783
H -4.293908 -0.512498 1.130210
H -4.146073 -0.757578 -0.606955
H 2.225473 -1.930759 -0.904937
H 2.292111 -1.948394 0.857094
H -1.114129 3.080828 -0.095020
H 4.069352 3.077404 2.025831
H -5.682276 0.562615 -2.199751
H 1.542722 -4.094371 -2.148833
H 6.790559 4.192017 -1.997046
H 5.902487 4.737163 2.189080
H -8.848220 0.967758 1.626382
H -8.033163 1.237945 -2.600910
H 3.219461 -6.563480 1.841344
H 1.991010 -6.527321 -2.293648
H 7.266915 5.302900 0.184610
H -9.622656 1.445192 -0.695769
H 2.827040 -7.771093 -0.305273


%chk=000239683-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239683

0 1
Cl 4.717898 4.568552 -2.252195
Cl -7.287213 2.239523 1.853178
Cl 2.976972 -2.166086 1.777630
S 1.233737 3.417259 -1.139096
S -3.527235 2.484782 1.542230
S -0.441430 -1.715818 0.078633
N 0.302069 0.896220 -0.444068
N -1.806686 0.497200 0.693613
C 2.656551 2.252958 -1.685276
C 3.853230 2.334712 -0.774912
C -4.457077 0.856025 1.947904
C -5.388400 0.423604 0.846514
C 1.821218 -3.241055 -0.555928
C 1.228456 -1.887759 -0.844736
C 0.061974 2.241221 -0.389144
C -2.025423 1.841842 0.746831
C -1.102915 2.773876 0.209129
C -0.649068 0.093750 0.102215
C 4.865456 3.315282 -0.923096
C 4.015907 1.399560 0.283024
C -6.694211 0.951717 0.692015
C -4.978650 -0.566742 -0.087917
C 2.626458 -3.505700 0.579920
C 1.586585 -4.327751 -1.441626
C 5.991901 3.382519 -0.082424
C 5.134916 1.442674 1.140298
C -7.570071 0.535852 -0.327728
C -5.836895 -1.001055 -1.120082
C 3.183345 -4.771617 0.840900
C 2.129788 -5.607748 -1.203628
C 6.125535 2.434895 0.957946
C -7.133783 -0.450999 -1.241110
C 2.930098 -5.830809 -0.060116
H 2.203137 1.249567 -1.682009
H 2.881293 2.577792 -2.711523
H -4.985244 1.101403 2.881415
H -3.667045 0.112161 2.127446
H 1.020505 -1.751082 -1.916601
H 1.851355 -1.057671 -0.483074
H -1.286023 3.849783 0.248261
H 3.243481 0.637329 0.431670
H -3.967553 -0.976491 0.007882
H 0.965584 -4.152502 -2.327877
H 6.747926 4.157610 -0.237375
H 5.233297 0.704467 1.942830
H -8.570018 0.972205 -0.406035
H -5.496091 -1.765537 -1.826139
H 3.801393 -4.926187 1.729843
H 1.931696 -6.424691 -1.904937
H 6.998715 2.477862 1.617463
H -7.807122 -0.782083 -2.038875
H 3.358476 -6.819322 0.135433


