%chk=000250652.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250652

0 1
Cl -4.574185 -0.607042 -0.896867
S 3.507743 0.936389 -0.874454
N -1.098141 0.617365 0.796465
N 1.053543 0.527137 -0.042881
N 2.400305 -1.439213 -0.230912
C -0.750245 2.028951 0.394879
C 0.722363 1.981884 -0.084782
C -0.030918 -0.233453 0.428309
C -2.495001 0.166207 0.613057
C 0.098461 -1.607846 0.542442
C 2.311309 -0.066560 -0.363775
C -2.853187 -0.145374 -0.843075
C 1.362581 -2.164050 0.197470
H -0.866019 2.668136 1.297577
H -1.425504 2.425575 -0.387927
H 0.862819 2.377694 -1.114843
H 1.408302 2.553231 0.581339
H -2.650837 -0.738496 1.252039
H -3.171804 0.951562 1.027644
H -0.706510 -2.235083 0.903997
H -2.709686 0.723019 -1.513009
H -2.257139 -0.988172 -1.247922
H 1.522049 -3.250360 0.276827


%chk=000250652-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250652

0 1
Cl -4.944053 -0.730870 -0.366617
S 3.776382 1.030202 -0.395942
N -1.093895 0.607766 0.328182
N 1.143146 0.534105 0.024815
N 2.550938 -1.401014 -0.008523
C -0.704796 2.040078 0.194260
C 0.835727 1.984363 -0.059940
C 0.001832 -0.221971 0.238645
C -2.465698 0.158641 0.568598
C 0.110930 -1.617230 0.333182
C 2.450489 -0.017612 -0.113822
C -3.185553 -0.177946 -0.752822
C 1.435357 -2.132278 0.203000
H -0.949904 2.589264 1.122709
H -1.240858 2.519330 -0.644910
H 1.134725 2.363669 -1.051564
H 1.428894 2.529602 0.692463
H -2.461290 -0.729058 1.226758
H -3.018040 0.954497 1.099392
H -0.749033 -2.267213 0.496923
H -3.278991 0.695967 -1.414264
H -2.709439 -1.015270 -1.283612
H 1.593428 -3.215523 0.274685


