%chk=000199397.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199397

0 1
Cl -8.930799 -2.568908 -0.612830
O -3.835347 -1.757130 0.934084
O -3.113124 2.774161 0.442544
N 2.713878 -0.424603 -0.251238
N 5.596243 -0.113632 -0.264687
N -3.432064 0.482195 0.715029
N -5.171189 1.952033 -0.100797
C 3.358226 0.870289 0.144770
C 3.563759 -1.107145 -1.281725
C 4.747743 0.587048 0.749454
C 4.954819 -1.399031 -0.683148
C 1.322388 -0.203808 -0.767489
C 0.374362 -0.024137 0.431487
C -1.074609 0.140588 -0.038354
C 7.004420 -0.115969 -0.057986
C -2.012257 0.299397 1.165857
C 7.620988 0.905889 0.702929
C 7.826092 -1.065208 -0.711444
C -4.279278 -0.676085 0.612866
C -3.828253 1.795721 0.364035
C -5.646439 -0.417492 0.122800
C 9.009618 0.971589 0.793269
C 9.212868 -0.981139 -0.607904
C -6.073416 0.882157 -0.225256
C 9.816092 0.031358 0.144515
C -6.542503 -1.497957 0.001293
C -7.391905 1.106417 -0.694824
C -7.829557 -1.258893 -0.460337
C -8.263681 0.035271 -0.809978
H 2.719384 1.358028 0.912810
H 3.456457 1.582479 -0.703996
H 3.674683 -0.513654 -2.215509
H 3.079267 -2.070005 -1.552687
H 5.226690 1.552092 1.031378
H 4.641679 -0.017792 1.678056
H 4.857846 -2.102794 0.174199
H 5.586414 -1.895718 -1.454223
H 1.244695 0.663524 -1.457186
H 1.009507 -1.098971 -1.348989
H 0.685051 0.851208 1.034953
H 0.470352 -0.900536 1.105423
H -1.162143 1.022832 -0.704360
H -1.383406 -0.735463 -0.643334
H -1.973733 -0.604765 1.819384
H -1.721385 1.180783 1.782356
H 7.015303 1.654631 1.208985
H 7.380892 -1.856817 -1.310277
H 9.470869 1.766370 1.379300
H 9.833353 -1.716571 -1.119753
H -5.464527 2.903443 -0.345235
H 10.896966 0.087688 0.222809
H -6.208335 -2.506969 0.273297
H -7.717310 2.110569 -0.962056
H -9.285245 0.186335 -1.169678


%chk=000199397-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000199397

0 1
Cl -8.885232 -2.862330 -0.656878
O -3.746286 -1.729324 0.862006
O -3.249921 2.922052 0.428648
N 2.726807 -0.369841 -0.242459
N 5.626493 -0.187237 -0.175371
N -3.496303 0.590616 0.673403
N -5.292781 1.946057 -0.104130
C 3.401331 0.823931 0.322026
C 3.561277 -0.931277 -1.332321
C 4.787618 0.446421 0.868970
C 4.956090 -1.332403 -0.819633
C 1.337067 -0.103933 -0.690389
C 0.350743 0.120145 0.474063
C -1.102870 0.253711 -0.031538
C 7.039171 -0.175962 -0.053284
C -2.085063 0.480611 1.137304
C 7.720942 0.966817 0.470628
C 7.839451 -1.278848 -0.484070
C -4.255592 -0.610878 0.563596
C -3.963407 1.885472 0.338747
C -5.650146 -0.444104 0.089297
C 9.126258 1.000901 0.551013
C 9.247843 -1.227883 -0.407604
C -6.148412 0.846067 -0.240775
C 9.909376 -0.092834 0.110595
C -6.484684 -1.581203 -0.037796
C -7.483667 0.995889 -0.697155
C -7.799037 -1.412593 -0.488762
C -8.310265 -0.135097 -0.820817
H 2.795447 1.229252 1.151321
H 3.515370 1.628076 -0.450735
H 3.687733 -0.197790 -2.170283
H 3.059653 -1.829816 -1.737448
H 5.280752 1.353363 1.250272
H 4.651442 -0.253849 1.724849
H 4.853432 -2.191286 -0.116030
H 5.555046 -1.663801 -1.685283
H 1.290290 0.771296 -1.391015
H 1.001830 -0.990166 -1.264441
H 0.621092 1.033081 1.041209
H 0.436790 -0.734637 1.172398
H -1.178374 1.102779 -0.738468
H -1.394281 -0.665515 -0.575323
H -2.044439 -0.369112 1.839080
H -1.841456 1.416916 1.666300
H 7.155445 1.847866 0.790127
H 7.369098 -2.192132 -0.859260
H 9.614308 1.897510 0.951307
H 9.829630 -2.093852 -0.745424
H -5.617413 2.886417 -0.338041
H 11.002008 -0.059909 0.172369
H -6.073582 -2.560965 0.221995
H -7.875011 1.986460 -0.953338
H -9.341210 -0.030229 -1.170848


