%chk=000267820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267820

0 1
Cl -5.635220 0.490285 -2.089515
Cl -3.401292 2.146303 -2.719282
O -1.442386 1.417666 2.279342
O 1.326597 -3.668484 -0.234664
O -3.505622 2.167328 0.099506
O -0.249925 0.727813 0.482748
O 1.486491 5.288027 -1.181042
O 0.736800 5.736741 0.881480
O 5.910800 0.625381 0.035795
O 7.044324 -1.175155 -0.352049
N -3.773378 -0.041393 0.592075
N 5.996181 -0.576708 -0.165556
C -3.890038 -1.467100 0.190879
C -3.518912 0.232656 2.032087
C -2.534231 -2.112453 0.021802
C -2.046001 0.105352 2.445100
C -3.700521 1.033521 -0.297134
C -2.052914 -2.999260 0.997963
C -1.736636 -1.791017 -1.088325
C -0.753794 -3.504396 0.914412
C -0.438084 -2.285600 -1.197214
C 0.034855 -3.109832 -0.170651
C -3.914392 0.746497 -1.791713
C -0.523829 3.121207 0.980697
C -0.677302 1.641783 1.153135
C 0.557295 3.459646 -0.038852
C 2.410638 -2.812819 -0.220753
C 2.338642 -1.430669 0.011804
C 3.633277 -3.484300 -0.434942
C 0.894099 4.921051 0.005971
C 4.750805 -1.355251 -0.184412
C 3.522914 -0.701801 0.028739
C 4.806526 -2.745586 -0.414706
H -4.493986 -1.562779 -0.740990
H -4.491240 -2.001112 0.966690
H -4.150383 -0.445587 2.646019
H -3.857331 1.282731 2.253490
H -1.477024 -0.647801 1.868838
H -1.937060 -0.077064 3.529870
H -2.684917 -3.287844 1.838138
H -2.124924 -1.129730 -1.870629
H -0.352320 -4.180685 1.668253
H 0.198812 -2.027415 -2.042920
H -3.332379 -0.148162 -2.149488
H -0.327796 3.618392 1.961739
H -1.521396 3.531323 0.663134
H 1.485447 2.868569 0.144980
H 0.241476 3.164460 -1.067667
H 1.381681 -0.922422 0.182263
H 3.635637 -4.560038 -0.609811
H 3.510413 0.380082 0.208199
H 5.778872 -3.226829 -0.576858
H 1.752352 6.247180 -1.199474


%chk=000267820-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267820

0 1
Cl -5.706418 0.151917 -1.831444
Cl -3.560985 2.111943 -2.788188
O -1.552455 2.407630 2.337290
O 1.544977 -3.980563 -0.897960
O -3.788946 2.375056 0.184374
O -0.617058 1.976922 0.246709
O -1.407127 6.606924 -1.977339
O -0.459372 6.985927 0.107077
O 7.081202 -2.083576 1.686887
O 7.817618 -3.353326 -0.062031
N -3.379893 0.147947 0.731786
N 6.873791 -2.829650 0.650575
C -3.395583 -1.295051 0.399924
C -3.188098 0.529932 2.157204
C -2.035387 -1.943914 0.125725
C -1.762035 0.952781 2.567112
C -3.696518 1.164313 -0.163304
C -1.928245 -3.355081 0.225445
C -0.906073 -1.196449 -0.290348
C -0.721663 -4.014889 -0.083996
C 0.308330 -1.846198 -0.605204
C 0.390060 -3.250566 -0.494673
C -3.916699 0.729057 -1.629666
C -1.016147 4.303278 0.970041
C -1.028058 2.795987 1.103277
C -1.280974 4.725709 -0.486878
C 2.833593 -3.612630 -0.480288
C 3.095049 -2.806453 0.657554
C 3.893208 -4.166938 -1.241621
C -0.997637 6.196120 -0.701371
C 5.477117 -3.101303 0.258919
C 4.427035 -2.551182 1.027891
C 5.222790 -3.911414 -0.873029
H -4.064031 -1.459430 -0.465040
H -3.887499 -1.823497 1.239820
H -3.480260 -0.340619 2.772910
H -3.871898 1.367047 2.386794
H -0.988095 0.371308 2.038756
H -1.646348 0.840422 3.657547
H -2.793747 -3.948307 0.546222
H -0.948719 -0.103095 -0.351867
H -0.629108 -5.102595 -0.015703
H 1.169948 -1.261600 -0.942915
H -3.296437 -0.114629 -1.955349
H -0.027845 4.683456 1.294839
H -1.761255 4.732706 1.657335
H -0.642482 4.143207 -1.178406
H -2.322362 4.502096 -0.780285
H 2.272526 -2.398025 1.250487
H 3.650713 -4.788108 -2.107995
H 4.667824 -1.940265 1.901719
H 6.063124 -4.320321 -1.439497
H -1.193747 7.572692 -2.093320


