%chk=000182820.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182820

1 1
Cl 6.436906 3.245767 -1.660251
N 1.090393 0.672935 1.558356
N -6.165388 0.919607 -0.497693
N -2.620872 -0.255102 -0.178481
C -0.270579 -0.843302 0.164904
C 0.996382 -0.507254 0.757694
C -1.419430 0.043690 0.369671
C -5.045574 -0.037956 -0.745685
C -3.836923 0.592502 -0.016538
C 2.386335 1.065016 2.198181
C -0.356464 -2.014629 -0.597908
C 2.106434 -1.327078 0.559603
C 0.750879 -2.854853 -0.798568
C 2.008474 -2.503485 -0.212097
C -1.223257 1.212300 1.154548
C 0.004259 1.496779 1.715307
C -6.544791 1.664835 -1.745950
C -7.347973 0.264654 0.150904
C 3.384991 1.604534 1.203990
C 0.658315 -4.061687 -1.583628
C 3.142779 -3.362742 -0.427814
C -7.291193 2.945428 -1.376590
C -7.023902 -0.119013 1.593629
C 1.754621 -4.853085 -1.765094
C 3.016996 -4.496955 -1.178410
C 3.016973 2.590219 0.276209
C 4.708601 1.138146 1.245644
C 3.960686 3.101573 -0.617103
C 5.660845 1.647417 0.360851
C 5.273681 2.622213 -0.565004
H -4.824445 -0.182148 -1.824386
H -5.263177 -1.047702 -0.334313
H -4.077701 0.712149 1.068225
H -3.642815 1.616078 -0.418222
H -2.731082 -1.104137 -0.738517
H 2.193932 1.837649 2.984756
H 2.791887 0.180462 2.750529
H -1.307021 -2.298832 -1.059832
H 3.081067 -1.071334 0.982730
H -2.049748 1.905414 1.329418
H 0.137869 2.407438 2.325988
H -7.160149 1.050313 -2.439539
H -5.614579 1.932987 -2.294391
H -7.713736 -0.620342 -0.413441
H -8.183342 1.005300 0.151162
H -0.303969 -4.323248 -2.025542
H 4.099370 -3.086667 0.018486
H -8.284550 2.741239 -0.957564
H -6.742745 3.527844 -0.624152
H -7.432149 3.584797 -2.256354
H -7.930746 -0.448658 2.117852
H -6.621925 0.737911 2.150586
H -6.295046 -0.931737 1.661883
H 1.699784 -5.769913 -2.357178
H 3.871432 -5.157817 -1.349860
H 1.995754 2.967030 0.242223
H 5.010665 0.385343 1.974727
H 3.681405 3.868167 -1.343414
H 6.694355 1.294138 0.391562


%chk=000182820-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182820

1 1
Cl 6.876960 3.053439 -1.737317
N 1.139200 0.796142 1.478127
N -6.295352 0.804793 -0.379413
N -2.656716 -0.164041 -0.102994
C -0.280321 -0.761042 0.171988
C 1.019070 -0.398215 0.719137
C -1.427869 0.125194 0.397446
C -5.107844 -0.056780 -0.499664
C -3.875571 0.650789 0.109215
C 2.443221 1.184990 2.100003
C -0.386229 -1.964777 -0.555775
C 2.130818 -1.230829 0.503642
C 0.723290 -2.819601 -0.778938
C 2.017836 -2.437187 -0.238030
C -1.215314 1.307681 1.164665
C 0.046620 1.595188 1.675695
C -6.423218 1.788333 -1.495485
C -7.554324 0.055313 -0.097062
C 3.519838 1.618779 1.109009
C 0.607637 -4.044425 -1.523116
C 3.149346 -3.291462 -0.469587
C -7.198011 3.057149 -1.096047
C -7.633669 -0.467793 1.348682
C 1.723577 -4.851682 -1.726869
C 3.004178 -4.470738 -1.197053
C 3.209397 2.410837 -0.023288
C 4.870637 1.275305 1.362132
C 4.227944 2.849666 -0.895903
C 5.902007 1.713817 0.503500
C 5.564206 2.494359 -0.620072
H -4.886002 -0.339267 -1.562084
H -5.285876 -0.997238 0.053580
H -4.051303 0.802252 1.190128
H -3.746981 1.646728 -0.357698
H -2.774012 -0.997209 -0.684144
H 2.216507 2.012246 2.796836
H 2.803245 0.341555 2.716901
H -1.348184 -2.284394 -0.974187
H 3.115415 -0.950195 0.883662
H -2.027029 2.006168 1.366666
H 0.211827 2.496606 2.270804
H -6.900661 1.316074 -2.388703
H -5.402615 2.082562 -1.808947
H -7.693054 -0.786825 -0.818745
H -8.394524 0.750943 -0.264804
H -0.367718 -4.334708 -1.929522
H 4.127320 -3.003754 -0.068692
H -8.237874 2.831474 -0.801382
H -6.706255 3.559114 -0.244885
H -7.241384 3.761915 -1.946240
H -8.595895 -0.985506 1.513884
H -7.559084 0.369946 2.063091
H -6.829344 -1.191021 1.580606
H 1.633714 -5.783015 -2.294539
H 3.869297 -5.118268 -1.371249
H 2.171888 2.690138 -0.240571
H 5.132947 0.670440 2.239204
H 3.989957 3.459451 -1.772056
H 6.945136 1.452787 0.702558


