%chk=000222238.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222238

0 1
Cl 3.199908 3.360827 -0.068925
N -0.411600 -0.066099 -0.016534
N 4.012489 -1.685986 0.023467
N 1.377026 1.482460 -0.039889
N 3.738526 0.794841 -0.021689
N 3.174514 -2.777237 0.040957
C -1.401594 1.046204 -0.038945
C 1.889772 -0.890063 0.003940
C 0.934919 0.171013 -0.017428
C -2.792394 0.469236 -0.015021
C 3.279193 -0.503374 0.000422
C 1.901630 -2.326698 0.029753
C -3.454428 0.181380 -1.217281
C -3.427691 0.218333 1.209811
C 2.731092 1.705411 -0.040470
C -4.747008 -0.349621 -1.192223
C -4.720228 -0.312858 1.229486
C -5.380873 -0.597077 0.029801
H -1.228374 1.680009 -0.944052
H -1.217769 1.725961 0.830228
H -0.766651 -1.017147 -0.000572
H 1.050406 -2.988800 0.039534
H -2.964688 0.374160 -2.171300
H -2.916934 0.440093 2.146381
H 5.017589 -1.798825 0.027902
H -5.261608 -0.569328 -2.126963
H -5.213993 -0.503931 2.181596
H -6.388932 -1.009184 0.047213


%chk=000222238-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222238

0 1
Cl 3.225596 3.419915 -0.076253
N -0.402587 -0.051499 -0.016117
N 4.024202 -1.664557 0.024929
N 1.392830 1.458489 -0.041436
N 3.744152 0.783621 -0.023394
N 3.225166 -2.813030 0.045876
C -1.389350 1.056685 -0.040028
C 1.908759 -0.913084 0.005700
C 0.948282 0.157561 -0.017196
C -2.801021 0.494354 -0.015882
C 3.280160 -0.503547 0.000610
C 1.944160 -2.347210 0.034007
C -3.481686 0.202713 -1.225965
C -3.451490 0.231593 1.217393
C 2.731521 1.670151 -0.042444
C -4.785088 -0.343472 -1.205298
C -4.754670 -0.314753 1.241993
C -5.423845 -0.604666 0.029656
H -1.215331 1.668929 -0.943663
H -1.202605 1.716079 0.826993
H -0.758102 -1.008291 -0.000669
H 1.130598 -3.071068 0.046610
H -2.991314 0.412423 -2.184837
H -2.937647 0.464209 2.158537
H 5.037992 -1.757301 0.028871
H -5.302090 -0.559038 -2.146980
H -5.248127 -0.507686 2.201059
H -6.436168 -1.023820 0.047128


