%chk=000229863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229863

0 1
Cl 3.016832 -1.849162 -0.088029
N -1.928464 -0.478401 0.025111
N -0.282204 1.213597 0.002169
N 2.111086 0.621032 -0.058146
N 0.028051 -2.530553 -0.051475
N 1.393438 2.874307 -0.130705
C -0.606954 -0.132463 -0.007452
C -3.012731 0.539677 0.056505
C 0.426054 -1.144663 -0.043404
C -4.372843 -0.143464 0.010386
C 1.744521 -0.679339 -0.063114
C 1.057104 1.535276 -0.046984
H -2.905007 1.159441 0.978557
H -2.884596 1.238456 -0.805211
H -2.180565 -1.468167 0.023734
H -4.508089 -0.737506 -0.902793
H -4.533209 -0.809975 0.867477
H -5.178600 0.602522 0.029296
H 0.434859 -3.013300 0.750485
H 0.385699 -2.988954 -0.890336
H 2.358364 3.144673 -0.008113
H 0.685055 3.570865 0.040342


%chk=000229863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229863

0 1
Cl 3.091485 -1.893995 -0.096368
N -1.901229 -0.423817 0.009954
N -0.253719 1.269776 -0.006866
N 2.113850 0.644387 -0.057019
N -0.034979 -2.478294 -0.045340
N 1.443609 2.886089 -0.028346
C -0.585093 -0.059724 -0.012821
C -3.016980 0.530772 0.045903
C 0.414158 -1.111278 -0.042987
C -4.361484 -0.214971 0.014296
C 1.737204 -0.643078 -0.062924
C 1.083447 1.558728 -0.030511
H -2.940701 1.157097 0.956598
H -2.934248 1.223705 -0.813631
H -2.055556 -1.438947 0.013418
H -4.463458 -0.816804 -0.907441
H -4.466152 -0.889564 0.884213
H -5.196847 0.505635 0.043157
H 0.252642 -3.017039 0.779400
H 0.174139 -2.989586 -0.910389
H 2.430091 3.128854 -0.040253
H 0.717622 3.595954 -0.003744


