%chk=000105673.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000105673

0 1
Cl -2.099051 -3.430405 -1.064094
S 6.702230 -0.725235 -0.287318
S -5.917733 1.239618 0.436509
O 7.678788 -1.439101 0.899182
O -6.110730 0.919184 2.082477
O 7.611339 -0.007535 -1.125941
O 5.868695 -1.776705 -0.789109
O -5.269041 2.524216 0.409032
O -7.207599 1.047884 -0.162976
N 4.957093 1.151764 0.021974
N -0.638555 0.335406 -0.157962
N -1.151744 -0.809135 -0.221007
C 3.548434 0.888499 0.052993
C 5.823964 0.303902 0.865171
C -4.847544 -0.038553 0.015612
C 2.653352 1.980653 0.045051
C 3.059281 -0.431076 -0.024470
C 0.791816 0.432488 -0.095202
C -2.589573 -0.880103 -0.273388
C -3.468087 0.169244 0.057315
C 1.283376 1.753474 -0.034616
C 1.689247 -0.655474 -0.098389
C -5.371756 -1.282330 -0.360897
C -3.130330 -2.130336 -0.647307
C -4.513728 -2.331145 -0.695022
H 5.268495 -0.311286 1.614627
H 6.525417 0.905453 1.489048
H 5.187915 2.145902 0.135883
H 3.024959 3.002665 0.089191
H 3.747696 -1.282172 -0.077392
H -3.054489 1.149352 0.340828
H 0.583744 2.593632 -0.046037
H 1.303967 -1.677877 -0.167148
H -6.458212 -1.435491 -0.400949
H -4.917438 -3.302130 -0.990594
H 8.396793 -2.011377 0.604557
H -6.346790 1.671728 2.643071


%chk=000105673-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105673

0 1
Cl -2.061443 -3.737561 -0.381112
S 6.464482 -0.761722 -0.850491
S -5.891605 1.437693 -0.179616
O 8.262861 -0.847636 -0.257788
O -6.218582 1.348640 1.648379
O 6.343540 0.332853 -2.044531
O 5.944576 -2.279294 -1.133638
O -5.057867 2.786144 -0.496048
O -7.269350 1.113051 -0.964060
N 4.910219 1.101309 0.860945
N -0.656573 0.322787 0.171956
N -1.108017 -0.899085 0.035524
C 3.526705 0.848931 0.667708
C 5.875758 0.145654 1.064891
C -4.758097 -0.059744 -0.221501
C 2.636014 1.955497 0.645831
C 3.029260 -0.476249 0.497158
C 0.753922 0.419607 0.330647
C -2.524786 -0.981879 -0.115387
C -3.390987 0.148965 -0.067254
C 1.260806 1.739834 0.477083
C 1.653673 -0.686567 0.336794
C -5.352707 -1.319686 -0.423886
C -3.106636 -2.266655 -0.313341
C -4.497775 -2.439255 -0.472459
H 5.570554 -0.778764 1.566331
H 6.875658 0.515824 1.315470
H 5.223706 2.055686 0.664209
H 3.021203 2.974427 0.768979
H 3.708447 -1.333821 0.449356
H -2.953838 1.142713 0.076286
H 0.553341 2.574311 0.458836
H 1.250985 -1.693596 0.193750
H -6.434551 -1.418479 -0.552596
H -4.905432 -3.441320 -0.628882
H 8.793151 -1.370561 -0.924185
H -6.856418 2.085545 1.879346


