%chk=000227517.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227517

0 1
Cl 2.116744 -3.470562 -0.110187
N -0.793314 0.756470 0.056780
N 0.984885 2.227219 0.107500
N 0.528934 -1.388322 -0.020247
N 3.892302 1.194620 0.039892
N 2.960934 -0.994856 -0.033613
C 0.373762 -0.022485 0.026033
C 1.468735 0.911293 0.052089
C -2.159419 0.311071 0.027559
C -0.345418 2.127128 0.110077
C 2.798952 0.379665 0.019480
C -3.148974 1.184465 -0.460752
C -2.495604 -0.972855 0.487976
C 1.834248 -1.772736 -0.049428
C -4.480536 0.764291 -0.469632
C -3.833117 -1.373539 0.464176
C -4.826592 -0.509697 -0.007663
C 5.266145 0.657714 0.005548
H -1.047854 2.948297 0.159537
H -2.891413 2.169923 -0.842202
H -1.723530 -1.660810 0.847709
H 3.763607 2.203612 0.079132
H -5.253158 1.435433 -0.845038
H -4.099550 -2.370603 0.817240
H -5.866984 -0.830011 -0.019717
H 5.431442 0.051408 -0.906988
H 5.450046 -0.014313 0.867025
H 5.996930 1.479580 0.028314


%chk=000227517-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227517

0 1
Cl 2.113006 -3.546103 -0.039862
N -0.775284 0.766473 0.036600
N 1.002912 2.235475 0.071271
N 0.527582 -1.378394 0.004535
N 3.896495 1.177687 0.030229
N 2.948712 -0.992979 -0.004836
C 0.395840 -0.016116 0.025994
C 1.469419 0.911502 0.038336
C -2.144290 0.322953 0.013764
C -0.333590 2.109889 0.070459
C 2.794170 0.374939 0.021166
C -3.158468 1.206987 -0.432896
C -2.476455 -0.987193 0.438773
C 1.826749 -1.747014 -0.011434
C -4.505116 0.788259 -0.424723
C -3.826997 -1.395366 0.430296
C -4.847691 -0.513048 0.008797
C 5.268594 0.655618 0.013777
H -1.028421 2.942816 0.129126
H -2.906508 2.204319 -0.807492
H -1.685196 -1.675276 0.744876
H 3.726693 2.184512 0.050795
H -5.284055 1.476130 -0.770789
H -4.078558 -2.410055 0.756771
H -5.893743 -0.836790 0.008689
H 5.447086 0.043938 -0.888040
H 5.457655 0.014407 0.892683
H 5.971661 1.503829 0.023735


