%chk=000213690.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213690

0 1
Cl 4.529902 1.140407 -2.374855
Cl -3.916129 -3.083384 1.337366
O -0.637565 3.931392 -1.455233
O 0.494477 0.266135 1.814484
O -2.820294 3.357510 -0.116391
O -0.386673 -2.307955 -0.986704
O -1.370345 -3.566023 0.471621
N 0.270365 2.559698 0.246725
N 2.377016 -1.655855 1.415667
N -1.224197 -2.520564 -0.124154
C 1.356530 1.628415 0.010330
C -0.694279 2.636850 -0.887967
C 1.395089 0.498838 0.824610
C 2.407497 -0.518270 0.626183
C 3.387542 -0.316942 -0.387067
C 2.351885 1.825822 -0.990275
C -2.100689 2.394844 -0.275353
C -2.501383 1.013852 0.091080
C 3.330039 0.882400 -1.166852
C 4.368608 -1.341053 -0.568880
C -1.713245 -0.101353 -0.201108
C -3.728840 0.840300 0.767066
C -2.128629 -1.386156 0.194538
C 4.329785 -2.465323 0.217878
C -4.151704 -0.429010 1.148998
C -3.351068 -1.546211 0.866733
C 3.303034 -2.588292 1.209914
H -0.462089 1.945956 -1.735504
H 0.632491 3.503330 0.464725
H 2.314205 2.730044 -1.603790
H 5.137118 -1.221387 -1.335859
H -0.757347 -0.005438 -0.738050
H -4.345061 1.722444 0.985983
H 5.057042 -3.267492 0.103147
H -5.104027 -0.560324 1.670261
H 3.252388 -3.485289 1.842391
H -1.292523 4.551109 -1.025156
H -0.121628 1.056476 1.933601


%chk=000213690-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213690

0 1
Cl 4.734305 1.691496 -2.490123
Cl -5.585120 -2.527460 1.159115
O -0.273695 3.394350 -1.496550
O 0.962318 -0.381501 1.759780
O -2.530745 3.459770 -0.059802
O -1.745231 -2.762858 -1.024045
O -2.891866 -3.666601 0.731470
N 0.248900 1.833019 0.334756
N 3.410127 -1.689329 1.394298
N -2.573772 -2.688277 -0.036342
C 1.534284 1.225087 0.044478
C -0.627959 2.166544 -0.801760
C 1.860175 0.089617 0.815333
C 3.114689 -0.587875 0.612108
C 4.017158 -0.090751 -0.417342
C 2.416420 1.709531 -0.967024
C -2.069504 2.291588 -0.238558
C -2.858471 1.077547 0.113212
C 3.620905 1.051414 -1.183272
C 5.253328 -0.792327 -0.595524
C -2.377639 -0.234354 -0.105251
C -4.159828 1.252118 0.662809
C -3.173538 -1.348944 0.229762
C 5.537783 -1.901631 0.201296
C -4.956491 0.142316 0.982903
C -4.470735 -1.170026 0.774261
C 4.583373 -2.315253 1.184322
H -0.543187 1.354669 -1.542582
H 0.287765 2.593273 1.029205
H 2.127213 2.589459 -1.548999
H 5.956561 -0.445382 -1.358362
H -1.394934 -0.432373 -0.541572
H -4.528945 2.270139 0.821200
H 6.473759 -2.456451 0.085870
H -5.962762 0.276687 1.389263
H 4.784966 -3.185014 1.820563
H -0.865041 4.119695 -1.144550
H 0.152731 0.207589 1.675755


