%chk=000250670.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250670

0 1
Cl -4.519418 3.414233 -2.730416
O -0.201348 0.165691 1.817293
O 0.377383 -2.565216 0.480626
O 2.675134 -1.447746 0.905434
O 2.177203 2.177046 0.439155
O 1.420937 -3.378989 -1.361074
O 4.201646 -0.569719 -0.523372
O 4.160613 2.350568 1.513535
N -1.369061 0.492589 -0.208156
N -1.644507 2.373956 -1.516861
N -3.752001 -0.253151 -0.118660
N -5.240741 1.262798 -1.415217
N -6.066094 -0.680869 -0.355936
C 0.437993 -1.219412 -0.037227
C 1.696854 -0.478444 0.472868
C -0.744500 -0.506961 0.677978
C 1.245764 0.314830 1.719381
C 1.522213 1.824571 1.681808
C -2.738882 0.577400 -0.494051
C -0.760368 1.638222 -0.853619
C -2.895799 1.755089 -1.326051
C 0.920867 -3.591393 -0.285936
C 3.930398 -1.408508 0.300623
C -4.203262 2.048049 -1.759091
C 0.732054 -4.862272 0.459173
C 3.563597 2.368806 0.467491
C 4.752238 -2.508415 0.860186
C -4.984040 0.131685 -0.620659
C 4.038845 2.552593 -0.922183
H 0.371247 -1.245444 -1.147550
H 2.136297 0.172066 -0.326698
H -1.521192 -1.205376 1.089646
H 1.624743 -0.154434 2.657650
H 2.137795 2.155130 2.541673
H 0.576888 2.405463 1.653765
H 0.307262 1.827182 -0.768202
H 0.012857 -5.516716 -0.061685
H 0.350051 -4.700140 1.481963
H 1.679986 -5.417828 0.536645
H 4.989620 -3.252061 0.079599
H 4.250649 -3.038022 1.686977
H 5.713703 -2.123488 1.242027
H 4.893094 3.245885 -0.967063
H 4.387056 1.577872 -1.328913
H 3.255885 2.923322 -1.602058
H -6.994670 -0.363468 -0.595070
H -5.976791 -1.424676 0.319454


%chk=000250670-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250670

0 1
Cl -4.085681 3.317003 -3.281230
O -0.039913 0.533574 2.116354
O 0.092619 -2.422914 1.244734
O 2.670208 -1.434694 0.622567
O 2.339392 2.235104 1.102988
O 0.881762 -3.652783 -0.578660
O 3.364155 -0.499623 -1.407453
O 4.627297 1.776302 0.916560
N -1.332129 0.800841 0.122978
N -1.543175 2.711501 -1.139337
N -3.370485 -0.397770 -0.581559
N -4.663693 0.888906 -2.231732
N -5.389005 -1.207205 -1.484457
C 0.181362 -1.185473 0.434708
C 1.545698 -0.498150 0.652150
C -0.801399 -0.180882 1.084446
C 1.401637 0.142604 2.046500
C 2.272753 1.371142 2.310195
C -2.513869 0.649900 -0.601905
C -0.793058 2.060754 -0.238463
C -2.628314 1.848753 -1.387284
C 0.488917 -3.616808 0.605833
C 3.511714 -1.363684 -0.520793
C -3.775320 1.887531 -2.208972
C 0.334306 -4.792965 1.540636
C 3.602257 2.319990 0.456521
C 4.531305 -2.469703 -0.477370
C -4.441475 -0.215179 -1.422921
C 3.489512 3.097630 -0.829161
H -0.038606 -1.412826 -0.620411
H 1.684109 0.270715 -0.128250
H -1.657246 -0.709066 1.537738
H 1.592226 -0.613511 2.833005
H 3.297398 1.064431 2.586064
H 1.825029 1.984001 3.108721
H 0.121462 2.437304 0.215201
H -0.497493 -5.429548 1.189410
H 0.128273 -4.464841 2.569173
H 1.250253 -5.406146 1.513353
H 4.033420 -3.421502 -0.738592
H 4.951215 -2.574079 0.535906
H 5.330897 -2.268897 -1.204491
H 4.401474 3.694988 -0.984874
H 3.413879 2.373147 -1.661722
H 2.599063 3.743145 -0.838594
H -6.185454 -1.088125 -2.104346
H -5.279078 -2.040593 -0.913961


