%chk=000298966.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298966

0 1
Cl -3.611998 -3.860112 -0.581522
Cl -6.794025 0.187807 0.013092
Cl 4.604968 -2.992720 2.037173
Cl 7.782588 0.495060 -0.287887
S -3.016022 0.889528 0.602176
O -3.298327 -0.034023 1.682150
O -3.548234 2.237180 0.607832
N -3.549107 0.190393 -0.885511
N 2.872066 1.204513 -0.185468
N 5.177217 0.805610 -0.193883
N 3.697288 -0.815620 0.887714
N 6.100300 -1.183490 0.846603
C -3.294323 -1.246995 -1.115307
C -4.681462 0.814304 -1.607023
C -1.302597 0.949330 0.382745
C -4.007026 -2.174628 -0.123947
C -6.014267 0.065785 -1.587454
C -0.727426 1.997228 -0.346073
C -0.486482 -0.031915 0.953327
C 1.469924 1.054356 0.048042
C 0.651717 2.059600 -0.522067
C 0.898830 0.008428 0.788931
C 3.906131 0.362404 0.192818
C 4.822398 -1.536320 1.182079
C 6.214491 0.001986 0.157356
H -2.190563 -1.415233 -1.061042
H -3.580091 -1.514340 -2.160174
H -4.830775 1.854491 -1.208463
H -4.368049 0.931772 -2.675277
H -3.681566 -2.012598 0.929901
H -5.106998 -2.062695 -0.136306
H -6.713992 0.503852 -2.327160
H -5.904409 -1.009264 -1.825865
H -1.362295 2.781731 -0.775634
H -0.932447 -0.841663 1.547471
H 1.084139 2.880931 -1.091024
H 1.514924 -0.775156 1.245706
H 3.166201 2.050179 -0.705330


%chk=000298966-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298966

0 1
Cl -3.641859 -4.033185 -0.710161
Cl -6.811367 0.138265 0.188324
Cl 4.797955 -2.872625 2.306504
Cl 7.908283 0.582514 -0.383465
S -3.077315 0.883086 0.641036
O -3.333031 -0.108525 1.909907
O -3.629746 2.414850 0.602576
N -3.652479 0.132898 -0.954124
N 2.943291 1.133731 -0.207811
N 5.237797 0.811638 -0.241963
N 3.825280 -0.754852 0.980514
N 6.228743 -1.065480 0.922213
C -3.358987 -1.300957 -1.127070
C -4.752054 0.828728 -1.632821
C -1.214085 0.922128 0.375478
C -4.187207 -2.275257 -0.257992
C -6.155563 0.207722 -1.574738
C -0.674411 1.958831 -0.405039
C -0.424518 -0.053434 1.002749
C 1.549447 1.009639 0.028312
C 0.719653 1.997951 -0.576069
C 0.974132 -0.016546 0.825365
C 4.002228 0.363310 0.200677
C 4.968683 -1.400296 1.289789
C 6.275123 0.059730 0.153711
H -2.284644 -1.476083 -0.925143
H -3.516114 -1.531130 -2.199121
H -4.783722 1.856665 -1.222578
H -4.481643 0.911263 -2.708977
H -3.984030 -2.150723 0.814006
H -5.266689 -2.239359 -0.451018
H -6.865702 0.835514 -2.136081
H -6.190219 -0.825231 -1.953917
H -1.322500 2.722534 -0.845372
H -0.889947 -0.813142 1.639136
H 1.166867 2.799206 -1.176513
H 1.617254 -0.761724 1.294749
H 3.243795 1.928046 -0.782376


