%chk=000258971.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258971

0 1
Cl 5.114001 -1.774486 1.382797
N -2.279608 0.345253 0.407209
N 0.592089 0.271922 0.044036
N -4.176486 -1.404578 -1.948379
C -1.620678 1.087611 -0.718901
C -1.495110 -0.905763 0.677113
C -3.744709 0.099336 0.186261
C -0.198244 1.496271 -0.285448
C -0.070757 -0.519031 1.124275
C -4.471149 1.440832 -0.021107
C -4.342323 -0.622727 1.407405
C 2.003304 0.352405 0.028411
C -3.988988 -0.749383 -1.017942
C 2.786834 -0.617664 0.700355
C 2.661490 1.336668 -0.754033
C 4.168811 -0.576549 0.556871
C 4.048245 1.337725 -0.867742
C 4.830507 0.380101 -0.210091
H -2.202644 2.007128 -0.945142
H -1.573107 0.487230 -1.655674
H -1.444169 -1.577238 -0.209890
H -1.982298 -1.477513 1.496385
H -0.250018 2.187584 0.586407
H 0.293035 2.046138 -1.120978
H 0.512895 -1.448173 1.320335
H -0.113474 0.057040 2.076585
H -4.177553 1.941841 -0.951242
H -5.558609 1.303690 -0.057360
H -4.251026 2.128716 0.807347
H -3.956043 -1.641976 1.527563
H -5.433745 -0.698279 1.330983
H -4.111953 -0.072063 2.330281
H 2.321659 -1.393512 1.305703
H 2.080596 2.088232 -1.285366
H 4.537397 2.098336 -1.478346
H 5.913028 0.382877 -0.297181


%chk=000258971-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258971

0 1
Cl 5.198461 -1.388560 1.940039
N -2.298284 0.322586 0.394500
N 0.595487 0.294661 0.051486
N -4.146482 -1.227933 -2.121972
C -1.637854 1.163663 -0.644274
C -1.508782 -0.930338 0.558521
C -3.772212 0.114082 0.191237
C -0.205038 1.511644 -0.209299
C -0.065976 -0.620317 0.998825
C -4.509244 1.481484 0.121441
C -4.372382 -0.702957 1.370097
C 2.007487 0.348213 -0.006849
C -4.027974 -0.634542 -1.091773
C 2.813780 -0.419004 0.890000
C 2.677304 1.143203 -0.989249
C 4.212335 -0.386552 0.764456
C 4.081556 1.156451 -1.072259
C 4.885398 0.384687 -0.197616
H -2.192038 2.108246 -0.762937
H -1.610143 0.643234 -1.631373
H -1.479154 -1.516315 -0.391405
H -1.967247 -1.558403 1.338541
H -0.254371 2.139018 0.709990
H 0.265517 2.112581 -1.002100
H 0.484321 -1.576365 1.026812
H -0.080304 -0.194814 2.029208
H -4.265190 2.054591 -0.787290
H -5.599524 1.315851 0.124154
H -4.233919 2.076169 1.009899
H -4.029290 -1.749738 1.384120
H -5.472221 -0.716994 1.290568
H -4.086532 -0.214953 2.318178
H 2.369585 -1.012695 1.690980
H 2.102358 1.726591 -1.713905
H 4.566110 1.766268 -1.842760
H 5.975662 0.385257 -0.266489


