%chk=000227483.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227483

0 1
Cl 0.440406 3.464269 0.989457
O -4.411340 -1.291814 0.633222
N 2.575862 -1.085381 0.019481
N -2.018506 -0.481969 -0.828752
N 2.077742 -2.280600 -0.440471
N 1.649122 1.184520 0.524292
N -0.770677 1.317602 0.102652
C 0.357084 -0.783043 -0.325620
C 1.569745 -0.130978 0.109574
C -0.829000 0.010689 -0.330031
C -3.281112 0.282390 -0.702007
C 0.751263 -2.122247 -0.655303
C -3.945123 0.073663 0.665142
C 3.998227 -0.921798 0.347262
C 0.454371 1.817533 0.484625
H -3.965333 -0.068631 -1.511546
H -3.088539 1.371432 -0.868178
H -2.134262 -1.495632 -0.881702
H 0.124920 -2.919072 -1.024237
H -4.811081 0.746172 0.800633
H -3.235824 0.203012 1.502718
H 4.298629 -1.628575 1.143526
H 4.627751 -1.117238 -0.541375
H 4.186898 0.112643 0.697561
H -4.796623 -1.537848 1.495876


%chk=000227483-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227483

0 1
Cl 0.840344 3.718217 0.423427
O -4.472417 -1.531768 0.014241
N 2.628469 -1.092112 0.010600
N -2.021769 -0.360069 -0.288570
N 2.059733 -2.359924 -0.182394
N 1.865034 1.240363 0.215646
N -0.564262 1.461151 0.038426
C 0.401014 -0.755522 -0.133032
C 1.664088 -0.105662 0.045074
C -0.748368 0.108237 -0.130888
C -3.223645 0.483699 -0.301320
C 0.715867 -2.146815 -0.267209
C -4.314661 -0.164429 0.553477
C 4.074662 -0.933743 0.146064
C 0.701370 1.914366 0.197640
H -3.595109 0.598057 -1.338626
H -2.950352 1.480423 0.080415
H -2.186642 -1.363187 -0.398413
H 0.060752 -3.002907 -0.421117
H -5.255823 0.413938 0.459351
H -4.003193 -0.197619 1.617328
H 4.440933 -1.500794 1.017930
H 4.585027 -1.297330 -0.761185
H 4.283236 0.138380 0.285459
H -5.159688 -2.025854 0.524476


