%chk=000179310.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179310

0 1
Cl -5.687071 1.238570 1.843262
S -2.758951 0.932824 1.273311
F 3.443144 -2.934790 1.850450
F 4.898599 -2.628473 0.349398
F 5.074076 -1.638957 2.215948
F 3.522339 3.437978 -1.624632
F 5.146204 2.993724 -0.344986
F 4.935384 1.971545 -2.190168
F -6.960920 0.106946 -0.420843
F -5.998173 0.326499 -2.290222
F -6.013975 -1.556953 -1.317700
O -0.665085 1.001012 1.474273
N -0.965851 0.025054 -0.546380
N -3.368711 -0.227259 -1.026249
C 1.346203 0.384612 0.309636
C -0.129932 0.490898 0.476247
C -0.502340 -0.695956 -1.771516
C 3.411414 -0.798848 0.720632
C 3.436451 1.328443 -0.448377
C 2.044217 1.417268 -0.330401
C 2.018814 -0.720634 0.846471
C -2.345931 0.146248 -0.281156
C 4.123647 0.223355 0.076183
C -0.431335 -2.197584 -1.536536
C 4.178272 -1.972283 1.274011
C 4.230754 2.410322 -1.134071
C -4.576256 0.108012 -0.377569
C -4.448660 0.724928 0.841575
C -5.847964 -0.245851 -1.086471
H -1.224126 -0.467386 -2.597210
H 0.485593 -0.285637 -2.075431
H 1.493263 2.279318 -0.723369
H 1.448950 -1.502187 1.361445
H 5.215701 0.160026 -0.015872
H 0.286428 -2.474941 -0.757794
H -1.411827 -2.606702 -1.243423
H -0.138344 -2.722542 -2.456666


%chk=000179310-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179310

0 1
Cl -6.013815 0.692614 2.061301
S -2.962041 0.331033 1.767302
F 4.013582 -2.833650 2.135669
F 5.777116 -2.026765 0.950341
F 5.146280 -1.015749 2.876299
F 3.282016 2.015034 -2.887874
F 3.723704 3.405930 -1.158055
F 5.308673 1.941670 -1.862364
F -6.930823 0.432182 -0.798885
F -5.497845 1.235582 -2.362644
F -5.718290 -0.999728 -2.073820
O -0.358185 0.057386 2.002930
N -0.965542 -0.057978 -0.245248
N -3.261978 0.063272 -0.884176
C 1.455302 0.035465 0.430849
C -0.008271 0.001430 0.781320
C -0.659617 -0.487201 -1.656968
C 3.715823 -0.749380 0.929481
C 3.389628 1.051320 -0.667037
C 1.991477 0.984255 -0.468910
C 2.326150 -0.817060 1.151217
C -2.332648 0.086642 0.058261
C 4.260490 0.183176 0.018612
C -0.912728 -1.991238 -1.865057
C 4.644527 -1.646305 1.706878
C 3.928663 2.081625 -1.624620
C -4.549385 0.250370 -0.369706
C -4.614258 0.421183 1.003243
C -5.662582 0.233306 -1.374557
H -1.304651 0.108088 -2.322233
H 0.390030 -0.242406 -1.868459
H 1.334394 1.684884 -0.995113
H 1.911732 -1.520661 1.879175
H 5.339281 0.229165 -0.154649
H -0.278586 -2.604796 -1.200417
H -1.970642 -2.243409 -1.686667
H -0.672978 -2.258689 -2.909620


