%chk=000245071.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245071

0 1
Cl -5.248364 3.553488 0.590173
N 4.589600 0.649226 -0.352743
N -0.276446 -1.126846 0.779215
N -1.756509 -2.021813 -0.839986
N -2.837465 -1.964629 -1.570953
C 2.064112 -1.864648 1.065246
C 2.664849 -0.835905 0.102771
C 0.644389 -2.298440 0.648743
C 4.121536 -0.508958 0.477793
C 5.761428 1.338463 0.284136
C 4.912403 0.213595 -1.753806
C 0.141754 -3.454160 1.519661
C -1.448077 -1.022113 0.069234
C 5.296452 2.164767 1.484646
C 4.913359 1.423693 -2.688979
C -2.338007 0.119483 0.241526
C -3.503661 0.139443 -0.569501
C -2.102145 1.188522 1.152262
C -4.422597 1.224242 -0.458496
C -3.709808 -0.951975 -1.480315
C -2.991548 2.233037 1.255312
C -4.151976 2.230333 0.436377
H 2.066796 -1.471450 2.099676
H 2.707566 -2.767880 1.097783
H 2.069204 0.099698 0.101670
H 2.614198 -1.207823 -0.940235
H 0.644414 -2.623136 -0.430478
H 4.169028 -0.216990 1.550427
H 4.761316 -1.409972 0.369157
H 6.212818 2.021733 -0.471167
H 6.562846 0.632629 0.590921
H 4.125156 -0.500281 -2.088176
H 5.880181 -0.327718 -1.824925
H 0.086531 -3.193762 2.580493
H -0.865824 -3.766033 1.202089
H 0.786981 -4.334311 1.422917
H -0.070924 -0.451145 1.507207
H 6.104151 2.800666 1.860309
H 4.951700 1.533040 2.310395
H 4.455893 2.815147 1.205559
H 4.983362 1.111875 -3.735811
H 5.747277 2.103638 -2.482024
H 3.989698 2.007507 -2.571277
H -1.204159 1.177507 1.771263
H -5.316875 1.235970 -1.082180
H -4.590052 -0.982774 -2.125416
H -2.823358 3.058260 1.947206


%chk=000245071-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245071

0 1
Cl -5.402458 3.613366 0.808366
N 4.702643 0.634888 -0.351981
N -0.319036 -1.158009 0.745129
N -1.809696 -2.036695 -0.818133
N -2.984807 -1.978088 -1.557320
C 2.035372 -1.877970 0.964466
C 2.645581 -0.766031 0.081358
C 0.606369 -2.304241 0.558452
C 4.099460 -0.436308 0.482986
C 5.768092 1.389940 0.362465
C 5.150949 0.135425 -1.681698
C 0.118377 -3.542338 1.346633
C -1.512135 -1.031541 0.072487
C 5.207758 2.393834 1.388438
C 5.188840 1.238435 -2.756827
C -2.391645 0.113450 0.298004
C -3.609443 0.134130 -0.467350
C -2.126881 1.183419 1.203879
C -4.535203 1.211171 -0.308371
C -3.840552 -0.950636 -1.384148
C -3.036872 2.238025 1.357255
C -4.235009 2.230916 0.592137
H 2.036085 -1.561006 2.031382
H 2.678012 -2.779276 0.916988
H 2.049615 0.164005 0.143009
H 2.605302 -1.087311 -0.978208
H 0.578477 -2.551440 -0.519148
H 4.100432 -0.094452 1.535631
H 4.714286 -1.374184 0.457779
H 6.347740 1.951105 -0.392711
H 6.492170 0.698189 0.865175
H 4.439512 -0.644991 -2.007993
H 6.152637 -0.361645 -1.611457
H 0.122274 -3.348493 2.435810
H -0.904034 -3.808937 1.031746
H 0.776633 -4.407814 1.146664
H -0.074745 -0.473758 1.460347
H 6.030844 2.947442 1.878179
H 4.625404 1.891326 2.182317
H 4.543108 3.117058 0.884832
H 5.500671 0.818138 -3.731378
H 5.899328 2.044625 -2.498613
H 4.188489 1.691130 -2.869294
H -1.206848 1.210248 1.798359
H -5.461764 1.225612 -0.890436
H -4.746257 -0.986435 -1.998627
H -2.835872 3.058921 2.051119


