%chk=000222249.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222249

0 1
Cl -2.601671 3.538924 -0.554326
N 0.817634 -0.120373 -0.516002
N -0.882576 1.566705 -0.507480
N -3.627806 -1.404195 0.281847
N -3.254324 1.037858 -0.113933
N -2.845746 -2.532711 0.335601
C 3.916893 -0.728679 0.346489
C 1.992838 0.796643 -0.781425
C 3.243770 -0.114280 -0.913788
C 4.728073 -1.961314 -0.118979
C 2.904367 -1.186656 1.408748
C 4.896090 0.280304 0.977504
C 2.103621 1.829150 0.341417
C 1.765497 1.500689 -2.131368
C -0.493731 0.246742 -0.377014
C -1.495575 -0.741139 -0.100257
C -2.855679 -0.278122 0.017967
C -1.564993 -2.157957 0.109163
C -2.215288 1.867540 -0.371147
C -5.080821 -1.466230 0.486705
H 3.000627 -0.932503 -1.622661
H 4.020512 0.476055 -1.444864
H 5.275822 -2.412126 0.715574
H 4.084412 -2.739757 -0.538237
H 5.467396 -1.695177 -0.880743
H 3.411886 -1.642445 2.266875
H 2.206950 -1.933264 1.019303
H 2.320035 -0.340467 1.798503
H 4.383961 1.174306 1.345771
H 5.655462 0.609878 0.261630
H 5.425541 -0.159758 1.829506
H 1.240628 2.515139 0.341195
H 3.002139 2.443652 0.225783
H 2.137376 1.356148 1.332558
H 1.609249 0.793080 -2.950678
H 0.874373 2.149567 -2.096615
H 2.609320 2.145524 -2.393549
H 1.044055 -1.106676 -0.367919
H -0.751798 -2.864723 0.097962
H -5.553422 -2.122007 -0.268316
H -5.316427 -1.869646 1.489273
H -5.515471 -0.450297 0.399425


%chk=000222249-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222249

0 1
Cl -2.652478 3.594301 -0.738655
N 0.803465 -0.088068 -0.493066
N -0.916300 1.551953 -0.580323
N -3.654924 -1.334062 0.360255
N -3.272240 1.042561 -0.157900
N -2.896438 -2.506413 0.486305
C 3.934753 -0.764950 0.364144
C 1.971238 0.808085 -0.799949
C 3.242374 -0.104839 -0.882401
C 4.936449 -1.813344 -0.205628
C 2.946159 -1.505137 1.306314
C 4.756917 0.264092 1.191278
C 2.069099 1.938489 0.255636
C 1.767920 1.438832 -2.208546
C -0.516207 0.250164 -0.380808
C -1.517616 -0.733585 -0.052258
C -2.861695 -0.251618 0.037835
C -1.608499 -2.134357 0.235675
C -2.232662 1.840769 -0.456218
C -5.101497 -1.351838 0.565864
H 2.991325 -0.919253 -1.597577
H 4.018061 0.502084 -1.389827
H 5.500880 -2.296653 0.613347
H 4.412556 -2.605869 -0.773149
H 5.667655 -1.335705 -0.885003
H 3.504323 -1.992139 2.127983
H 2.399823 -2.311484 0.773958
H 2.208758 -0.822888 1.765483
H 4.119263 1.000640 1.705723
H 5.461646 0.817297 0.541852
H 5.352452 -0.260672 1.962609
H 1.199965 2.608933 0.161781
H 2.991604 2.523777 0.094314
H 2.083659 1.535847 1.282168
H 1.745531 0.657607 -2.990282
H 0.823217 2.004276 -2.239482
H 2.600322 2.130985 -2.430659
H 1.028320 -1.068159 -0.318791
H -0.830913 -2.895910 0.279347
H -5.581792 -2.031062 -0.157818
H -5.337409 -1.688881 1.588854
H -5.473867 -0.326403 0.417111


