%chk=000245587.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245587

0 1
Cl -6.296899 -2.598110 0.582360
Cl -6.388779 2.174678 -0.704357
Cl 8.263841 0.211105 0.461141
N -4.103454 -0.152761 0.030698
N 1.526762 0.045406 0.405059
C -4.927507 -0.337256 1.244860
C -4.832610 0.003466 -1.246015
C -2.705503 -0.099250 0.091496
C -2.029914 -0.230526 1.334074
C -1.936023 0.083855 -1.086941
C -5.064494 -1.814551 1.620532
C -5.021027 1.474352 -1.625277
C -0.644843 -0.180357 1.388928
C -0.549021 0.121684 -1.020849
C 0.118796 -0.012800 0.211973
C 3.825457 -0.005411 -0.286569
C 2.374375 -0.083827 -0.568904
C 4.732582 -0.328103 -1.312931
C 4.311171 0.384039 0.974472
C 6.108540 -0.263769 -1.086226
C 5.685571 0.453136 1.212130
C 6.562595 0.127579 0.175712
H -4.475207 0.223334 2.100055
H -5.934084 0.123105 1.087927
H -4.280102 -0.523184 -2.062866
H -5.821216 -0.514186 -1.175681
H -2.588948 -0.360728 2.256707
H -2.419971 0.189624 -2.053547
H -4.115573 -2.370639 1.483352
H -5.394202 -1.936496 2.669240
H -4.123481 2.083372 -1.397186
H -5.257773 1.587869 -2.699699
H -0.128873 -0.274084 2.348036
H 0.023163 0.267237 -1.937539
H 2.122733 -0.258692 -1.627468
H 4.366526 -0.633699 -2.292851
H 3.603372 0.631158 1.771587
H 6.814974 -0.513895 -1.876984
H 6.065646 0.754725 2.187951


%chk=000245587-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245587

0 1
Cl -6.047339 -2.864572 0.466763
Cl -6.160908 2.447967 -0.641258
Cl 8.422245 0.294331 0.360258
N -4.167757 -0.141682 0.023017
N 1.523812 0.039095 0.483977
C -4.995724 -0.347586 1.220588
C -4.856904 0.013920 -1.266199
C -2.765011 -0.096162 0.110031
C -2.086015 -0.240174 1.363324
C -1.948772 0.114134 -1.049718
C -5.073653 -1.804409 1.700110
C -4.984212 1.464842 -1.754187
C -0.686926 -0.178661 1.440932
C -0.548793 0.149332 -0.963289
C 0.122534 -0.006793 0.285287
C 3.835978 -0.042386 -0.267403
C 2.385954 -0.152524 -0.488070
C 4.734116 -0.277525 -1.345134
C 4.369211 0.298151 1.009229
C 6.129823 -0.178106 -1.164591
C 5.758844 0.400031 1.205096
C 6.620167 0.160216 0.111688
H -4.611364 0.268436 2.058880
H -6.011597 0.027842 1.014885
H -4.328765 -0.564691 -2.051461
H -5.859268 -0.437798 -1.185284
H -2.646764 -0.389897 2.289870
H -2.406119 0.264523 -2.031649
H -4.087538 -2.284391 1.772968
H -5.625185 -1.888497 2.649535
H -4.032647 2.013748 -1.717109
H -5.429957 1.514728 -2.760013
H -0.180687 -0.276918 2.406806
H 0.025632 0.337453 -1.878116
H 2.081669 -0.427289 -1.520696
H 4.338453 -0.540988 -2.333810
H 3.668793 0.477930 1.830595
H 6.819817 -0.359072 -1.993537
H 6.171458 0.660845 2.184089


