%chk=000197859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197859

0 1
Cl 7.383451 -1.961649 0.315342
O -5.618749 -1.778479 0.261842
O -6.434492 0.326781 0.201502
N -0.033899 1.118759 -0.577966
N 0.987852 0.203973 -0.400874
C 0.449303 2.526437 -0.278886
C 1.959396 2.334824 -0.029553
C 2.123845 0.822326 -0.152350
C -1.373989 0.717552 -0.321140
C 3.415038 0.141879 -0.034352
C -2.390634 1.699898 -0.299122
C -1.708251 -0.650312 -0.186260
C 4.478062 0.748663 0.659101
C 3.596206 -1.128064 -0.615526
C -3.717542 1.309793 -0.146379
C -3.036883 -1.023045 -0.034905
C -4.051414 -0.048198 -0.009925
C 5.708954 0.099603 0.770580
C 4.823679 -1.784066 -0.509672
C 5.863202 -1.158305 0.182302
C -5.470475 -0.406205 0.154565
C -6.976550 -2.265301 0.427539
H -0.069552 2.966359 0.594074
H 0.242352 3.157102 -1.166681
H 2.272140 2.699357 0.963807
H 2.575557 2.862331 -0.779784
H -2.157372 2.754135 -0.417404
H -0.923260 -1.408704 -0.207647
H 4.348048 1.727213 1.120058
H 2.769122 -1.603154 -1.150568
H -4.514201 2.060982 -0.130623
H -3.305973 -2.079087 0.068938
H 6.535285 0.564770 1.308307
H 4.967732 -2.767487 -0.958469
H -7.577996 -1.976972 -0.440463
H -7.404753 -1.853120 1.346751
H -6.835037 -3.348888 0.488738


%chk=000197859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197859

0 1
Cl 7.566318 -2.006144 -0.016924
O -5.719792 -1.846906 -0.009215
O -6.494764 0.353286 0.005566
N -0.028862 1.124243 0.005489
N 1.012497 0.201696 -0.000594
C 0.446887 2.542684 0.016379
C 1.992858 2.380166 0.013947
C 2.169825 0.856948 0.003954
C -1.364692 0.717317 0.004328
C 3.458442 0.166444 -0.001064
C -2.405124 1.694746 0.011300
C -1.706114 -0.669134 -0.004063
C 4.674812 0.907337 0.004324
C 3.530674 -1.259142 -0.011557
C -3.748428 1.289344 0.009753
C -3.052330 -1.057695 -0.005451
C -4.093717 -0.087540 0.001345
C 5.925463 0.254540 -0.000412
C 4.771186 -1.920664 -0.016399
C 5.956194 -1.152462 -0.010727
C -5.528517 -0.454058 -0.000140
C -7.131443 -2.287103 -0.011449
H 0.073531 3.062707 0.917408
H 0.072056 3.077334 -0.875335
H 2.460291 2.832501 0.906928
H 2.458847 2.843814 -0.873960
H -2.165593 2.762462 0.017841
H -0.903468 -1.409670 -0.009152
H 4.653072 2.002309 0.012310
H 2.600573 -1.835227 -0.015889
H -4.555324 2.029692 0.015019
H -3.317598 -2.118512 -0.011843
H 6.856425 0.828600 0.003844
H 4.821836 -3.013255 -0.024446
H -7.652199 -1.906092 -0.906463
H -7.651546 -1.917428 0.888674
H -7.084076 -3.385440 -0.018430


