%chk=000213799.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213799

0 1
Cl 4.255505 -1.658122 1.150938
N -2.543715 -0.551305 0.689347
N -0.404086 0.402205 0.314612
C -2.362450 -2.643924 -0.529517
C -3.367125 -1.653404 0.097791
C -0.976213 -1.989687 -0.403230
C -1.215289 -0.612650 0.195982
C -3.213429 0.755028 0.896697
C -3.632064 1.432915 -0.381160
C 0.984350 0.341830 0.029493
C 1.841901 -0.589378 0.648152
C 1.521083 1.328248 -0.826389
C 3.766445 0.455432 -0.460719
C 3.207693 -0.509440 0.389652
C 2.892393 1.377548 -1.062428
C -4.815914 2.017344 -0.544557
C 5.235856 0.494048 -0.704896
H -2.613331 -2.847836 -1.584455
H -2.389242 -3.616890 -0.008725
H -4.092236 -1.275654 -0.651546
H -3.947972 -2.121157 0.920054
H -0.466735 -1.906165 -1.380982
H -0.302537 -2.583436 0.243691
H -4.074281 0.583427 1.581885
H -2.498840 1.425710 1.444914
H -2.869827 1.432954 -1.164187
H 1.449443 -1.336162 1.334962
H 0.853718 2.055611 -1.287426
H 3.296246 2.144790 -1.722943
H -5.100971 2.528677 -1.453401
H -5.588662 2.042433 0.210003
H 5.593647 -0.454649 -1.134116
H 5.532710 1.296763 -1.390762
H 5.789729 0.645097 0.235265


%chk=000213799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213799

0 1
Cl 4.195238 -1.890426 1.239481
N -2.536485 -0.340914 0.217306
N -0.346735 0.499365 -0.009380
C -2.367692 -2.533720 -0.666532
C -3.322151 -1.586325 0.108707
C -0.951957 -2.011970 -0.301596
C -1.177828 -0.518904 -0.014323
C -3.128956 0.944980 0.612742
C -4.107257 1.472487 -0.420713
C 1.051525 0.391286 -0.143323
C 1.842475 -0.605137 0.505581
C 1.732487 1.386596 -0.901914
C 3.941895 0.376105 -0.403528
C 3.239227 -0.583973 0.360916
C 3.133692 1.364341 -1.030767
C -5.405908 1.771516 -0.167652
C 5.450034 0.376889 -0.541175
H -2.540110 -2.430561 -1.752297
H -2.517431 -3.590996 -0.393120
H -4.270848 -1.401271 -0.425922
H -3.569393 -1.984887 1.116188
H -0.201576 -2.158568 -1.095791
H -0.571576 -2.515244 0.607405
H -3.633442 0.844019 1.595270
H -2.276246 1.641766 0.727002
H -3.692821 1.617569 -1.429185
H 1.374615 -1.359394 1.144006
H 1.135770 2.168911 -1.380588
H 3.630860 2.137152 -1.629047
H -6.066807 2.173927 -0.943285
H -5.841247 1.634771 0.830832
H 5.817465 -0.572689 -0.972360
H 5.781408 1.203702 -1.192013
H 5.945575 0.489796 0.441074


