%chk=000236447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236447

0 1
Cl 0.265263 2.768491 -0.165685
Cl 5.218273 0.709671 0.293875
O -0.542065 -0.040748 -0.467646
O -1.291285 0.939717 1.445342
O 1.862254 -3.237437 -0.517465
O -0.073277 -2.532380 0.140583
N 1.088980 -2.360566 -0.173314
C -2.869584 0.144847 -0.324376
C -3.547978 1.475260 -0.705649
C -3.742098 -0.755402 0.570874
C -1.577177 0.442653 0.399273
C -3.959718 2.330108 0.486552
C -3.208920 -2.181044 0.632084
C 0.783463 0.137738 -0.184776
C 1.628331 -0.983343 -0.115602
C 1.329134 1.438818 -0.082325
C 3.018093 -0.804235 0.017561
C 2.697713 1.622492 0.075458
C 3.526861 0.487863 0.116580
H -2.633011 -0.414394 -1.273298
H -2.866955 2.054193 -1.364272
H -4.438682 1.246705 -1.327263
H -4.779049 -0.755619 0.178099
H -3.809063 -0.327372 1.592618
H -3.120579 2.507479 1.175431
H -4.759064 1.860773 1.071896
H -4.326701 3.310930 0.161974
H -2.154305 -2.220018 0.946559
H -3.778090 -2.789215 1.344572
H -3.259857 -2.684186 -0.341071
H 3.679277 -1.681045 0.042114
H 3.122415 2.627866 0.161496


%chk=000236447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236447

0 1
Cl 0.391217 3.130675 -0.414733
Cl 5.321036 0.810197 0.579394
O -0.558475 0.300948 -0.693747
O -1.229078 -0.000215 1.539976
O 1.955005 -3.093319 -0.489726
O -0.177202 -2.346860 -0.218296
N 1.092865 -2.151275 -0.301925
C -2.918782 -0.074962 -0.296822
C -3.413999 1.354190 -0.711533
C -3.907569 -0.825147 0.630202
C -1.553375 0.038735 0.348567
C -3.623421 2.332096 0.464513
C -3.599053 -2.332862 0.753604
C 0.787328 0.376746 -0.329677
C 1.621160 -0.766083 -0.169100
C 1.402571 1.648190 -0.208895
C 3.003092 -0.646637 0.098071
C 2.772994 1.798797 0.067021
C 3.554747 0.635510 0.219817
H -2.780203 -0.654033 -1.230585
H -2.690239 1.783916 -1.429086
H -4.367490 1.215386 -1.256951
H -4.926443 -0.682228 0.219392
H -3.894973 -0.362017 1.633998
H -2.686366 2.498070 1.026417
H -4.382434 1.961348 1.175756
H -3.967137 3.312595 0.088587
H -2.595218 -2.503473 1.180410
H -4.334995 -2.830658 1.410389
H -3.632913 -2.830948 -0.233497
H 3.605720 -1.552073 0.196664
H 3.214229 2.793992 0.161992


