%chk=000000298.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000298

0 1
Cl -6.089414 1.514459 0.836414
Cl -5.921726 -0.808965 -1.160856
O -0.735896 1.418741 1.462400
O -1.201141 -2.687755 0.222969
O -3.444139 1.546430 -0.831761
O 5.915342 -0.889637 -0.376178
O 5.678107 1.261114 -1.097910
N -2.707566 -0.401566 0.265161
N 5.214312 0.178698 -0.568478
C -1.305709 -0.329454 -0.198467
C -0.378081 0.076084 1.001775
C 1.090467 0.113527 0.611452
C -0.944200 -1.679878 -0.830734
C 1.910934 -1.025315 0.815745
C 1.645178 1.281238 0.028730
C -3.682689 0.494725 -0.156288
C 3.265419 -1.013786 0.431595
C 2.997637 1.310767 -0.362141
C 3.787901 0.157905 -0.158739
C -5.097185 0.062687 0.281810
H -1.252146 0.472659 -0.957326
H -0.529354 -0.670579 1.808371
H 0.116867 -1.692748 -1.141565
H -1.591198 -1.860060 -1.711840
H -2.956199 -1.281867 0.729946
H 1.484689 -1.919948 1.284205
H 1.013179 2.166716 -0.081764
H -1.722794 1.493902 1.516410
H 3.919160 -1.876340 0.583974
H 3.449505 2.199436 -0.810576
H -1.099994 -3.599406 -0.144761
H -5.106864 -0.662384 1.107028


%chk=000000298-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000000298

0 1
Cl -5.687672 0.434531 2.292364
Cl -6.228753 -0.137983 -0.670944
O -0.805891 1.918364 0.560692
O -0.963355 -2.585478 -0.114619
O -3.509550 1.554350 0.316352
O 5.764057 -1.235995 0.309395
O 5.853484 0.768265 -0.775691
N -2.722828 -0.617887 0.023842
N 5.211616 -0.161481 -0.150054
C -1.387729 -0.243192 -0.498067
C -0.515221 0.492501 0.607973
C 0.986517 0.326845 0.415530
C -0.801064 -1.515937 -1.123761
C 1.648392 -0.823700 0.919420
C 1.734906 1.325514 -0.256508
C -3.686578 0.297311 0.354158
C 3.034217 -0.991503 0.740291
C 3.122379 1.172737 -0.447983
C 3.751857 0.010554 0.049143
C -5.027280 -0.337541 0.747813
H -1.520474 0.507881 -1.302514
H -0.799595 0.053784 1.588664
H 0.261911 -1.360319 -1.379300
H -1.368264 -1.772569 -2.041410
H -2.831024 -1.620043 0.222248
H 1.071383 -1.587909 1.451345
H 1.213951 2.226045 -0.591605
H -1.804101 2.041368 0.508080
H 3.566998 -1.865173 1.124515
H 3.720674 1.930101 -0.961363
H -0.594391 -3.436311 -0.455522
H -4.966172 -1.417732 0.936116


