%chk=000268799.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268799

0 1
Cl 2.876329 2.647870 3.250736
Cl 6.301003 1.422281 -2.704242
Cl -2.946147 1.806206 3.800758
Cl -6.255696 2.259341 -2.230840
O 0.972603 1.266704 -1.090930
O 1.623657 -3.174090 0.470841
O -0.435747 -4.551929 0.961977
N 3.355832 0.473021 -0.113875
N -2.930632 1.247230 -0.192040
C 2.869960 -0.918602 -0.422854
C 1.371063 -0.992273 -0.324962
C -1.774105 1.058996 -1.132548
C -0.905165 -0.084091 -0.679228
C 0.517095 0.057573 -0.696922
C 0.772276 -2.200242 0.110102
C -1.448989 -1.283986 -0.257709
C -0.638174 -2.365738 0.154785
C 3.252098 0.781336 1.351460
C 4.744057 0.699381 -0.634915
C -2.483340 1.749023 1.146422
C -3.974797 2.135238 -0.798954
C 2.961944 2.275680 1.503056
C 4.642799 1.124480 -2.101300
C -3.474057 1.225364 2.188223
C -4.967976 1.226941 -1.527310
C -1.191495 -3.635986 0.619375
C -2.671302 -3.838748 0.685095
H 3.174353 -1.180675 -1.463824
H 3.333809 -1.689550 0.239436
H -2.182223 0.820503 -2.142778
H -1.161838 1.984597 -1.252027
H -2.538899 -1.390106 -0.236009
H 4.162402 0.494461 1.922278
H 2.416396 0.191727 1.801009
H 5.245994 1.503113 -0.047790
H 5.396589 -0.197396 -0.533630
H -1.463827 1.357538 1.374013
H -2.401807 2.856363 1.202431
H -4.507766 2.712497 -0.009627
H -3.560134 2.897231 -1.495419
H 3.750043 2.911749 1.059807
H 1.991504 2.555636 1.046426
H 4.184903 0.345182 -2.739771
H 4.062810 2.058434 -2.227174
H -4.503627 1.589413 2.019289
H -3.495863 0.120135 2.213970
H -4.499181 0.662039 -2.353177
H -5.446440 0.504365 -0.840314
H 2.013221 1.340002 -0.980137
H 1.121452 -4.054259 0.793105
H -3.143919 -3.746347 -0.302672
H -3.156229 -3.116671 1.356935
H -2.912915 -4.845862 1.065351


%chk=000268799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268799

0 1
Cl 3.562718 2.513720 3.412915
Cl 6.189360 1.403255 -3.182551
Cl -4.032144 1.392184 3.873342
Cl -6.010434 2.047488 -2.900541
O 1.183901 1.326018 -0.945379
O 1.594758 -3.274680 0.439658
O -0.476688 -4.547492 1.012141
N 3.459168 0.453604 -0.198165
N -2.985931 1.367516 -0.142913
C 2.910558 -0.934814 -0.473703
C 1.408193 -0.988961 -0.259797
C -1.657021 1.317297 -0.803429
C -0.838261 0.086045 -0.436797
C 0.590138 0.140761 -0.550611
C 0.794065 -2.188937 0.165933
C -1.418352 -1.115977 -0.021254
C -0.643517 -2.270519 0.298359
C 3.537705 0.727825 1.278912
C 4.762532 0.688375 -0.901693
C -2.937797 1.690389 1.303188
C -4.015025 2.100766 -0.916798
C 3.416758 2.231904 1.557046
C 4.521202 1.159824 -2.342566
C -4.043430 0.923162 2.040263
C -4.751950 1.114644 -1.833757
C -1.237981 -3.527381 0.747840
C -2.736615 -3.680247 0.921786
H 3.147862 -1.170475 -1.529702
H 3.414993 -1.696995 0.150542
H -1.826347 1.324705 -1.898506
H -1.051076 2.226148 -0.589251
H -2.509961 -1.145712 0.060384
H 4.480312 0.327954 1.704152
H 2.698763 0.202720 1.766656
H 5.329066 1.466153 -0.361768
H 5.381571 -0.232124 -0.899651
H -1.959077 1.373433 1.702919
H -3.040081 2.781092 1.500562
H -4.742033 2.566037 -0.227345
H -3.578609 2.923450 -1.523620
H 4.226287 2.825311 1.105935
H 2.434364 2.628212 1.261662
H 3.983994 0.421672 -2.955790
H 4.012300 2.133919 -2.383763
H -5.053235 1.175532 1.682609
H -3.880245 -0.163573 2.002080
H -4.076306 0.614166 -2.543598
H -5.328327 0.373659 -1.261331
H 2.238658 1.190234 -0.740917
H 0.942900 -4.044422 0.738255
H -3.270318 -3.502733 -0.029785
H -3.127623 -2.957563 1.661769
H -2.951839 -4.701471 1.269978


