%chk=000260045.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260045

0 1
Cl 5.951805 -2.474436 -0.814658
O -2.808337 1.999747 -0.133773
N -2.512359 -0.267864 0.066685
N -4.383246 -1.778561 0.117623
N 3.101999 0.435199 0.329384
C -4.786044 0.639444 -0.080307
C -1.066241 -0.099790 0.114311
C -3.081010 -1.571938 0.145197
C -3.344365 0.916113 -0.058360
C -5.267483 -0.687648 0.008262
C -0.420408 -0.043312 1.361157
C -0.346156 0.011266 -1.083706
C -5.702762 1.708933 -0.190472
C -2.152493 -2.733683 0.258431
C -6.662160 -0.937863 -0.013751
C 1.699170 0.197596 0.207703
C 0.962739 0.107468 1.407414
C 1.040892 0.154617 -1.035962
C -7.063873 1.454130 -0.211104
C -7.539991 0.126973 -0.122283
C 5.409892 0.116270 -0.208127
C 3.976235 -0.213368 -0.372788
C 6.402230 -0.857093 -0.408473
C 5.818986 1.414513 0.144586
C 7.760993 -0.566501 -0.278180
C 7.175988 1.719775 0.276021
C 8.145271 0.733938 0.063677
H -0.999188 -0.098756 2.283518
H -0.865338 0.000004 -2.042469
H -5.314653 2.729419 -0.257867
H -1.553765 -2.691047 1.181856
H -1.451900 -2.783786 -0.589666
H -2.709909 -3.688330 0.277628
H -7.014874 -1.967363 0.055641
H 1.482841 0.168801 2.365159
H 1.605890 0.257708 -1.961228
H -7.775962 2.272960 -0.295569
H -8.616233 -0.053109 -0.140102
H 3.755480 -1.012717 -1.102181
H 5.060495 2.182981 0.322727
H 8.509727 -1.342599 -0.438362
H 7.478557 2.730801 0.548640
H 9.203262 0.975811 0.166868


%chk=000260045-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260045

0 1
Cl 5.881629 -1.718992 -2.334371
O -2.742656 1.932041 -0.527452
N -2.534704 -0.321800 0.121651
N -4.442405 -1.771837 0.389412
N 3.113937 0.406242 0.461881
C -4.765584 0.603369 -0.267273
C -1.089479 -0.153260 0.189081
C -3.132894 -1.572407 0.412938
C -3.310433 0.837224 -0.252292
C -5.282055 -0.690949 0.059567
C -0.464443 0.059881 1.438659
C -0.325187 -0.160252 -0.998506
C -5.649175 1.662865 -0.601747
C -2.224786 -2.729637 0.753831
C -6.689267 -0.899604 0.046533
C 1.718774 0.191769 0.320128
C 0.929098 0.241872 1.501876
C 1.070908 0.006615 -0.937175
C -7.036160 1.442852 -0.609926
C -7.554113 0.156731 -0.283757
C 5.419541 0.127606 -0.236580
C 3.979929 -0.169963 -0.336511
C 6.388926 -0.490953 -1.070143
C 5.894450 1.072395 0.721255
C 7.762589 -0.201431 -0.975510
C 7.262193 1.375550 0.833926
C 8.200547 0.738553 -0.015895
H -1.072694 0.108182 2.348077
H -0.829749 -0.274710 -1.963294
H -5.217436 2.638823 -0.846684
H -1.679551 -2.558724 1.699225
H -1.464395 -2.895622 -0.029990
H -2.849566 -3.627922 0.858017
H -7.063833 -1.896231 0.298498
H 1.432659 0.426751 2.455434
H 1.654626 0.036594 -1.863872
H -7.720867 2.258060 -0.866378
H -8.637014 -0.009856 -0.291588
H 3.684514 -0.915105 -1.099288
H 5.142890 1.547084 1.360211
H 8.474444 -0.700354 -1.638842
H 7.602318 2.104236 1.576849
H 9.268173 0.969016 0.063126


