%chk=000189901.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189901

0 1
Cl 0.950192 -3.692971 -0.790940
N -1.609133 0.691736 -1.485876
N 0.128032 2.057971 -0.850698
N -0.473846 -1.525421 -1.173677
N 2.837475 0.906915 -0.022471
N 1.856418 -1.266986 -0.416344
C -2.970073 0.266075 -1.870169
C -0.548825 -0.148749 -1.150510
C -3.871797 0.189046 -0.663769
C 0.535943 0.718626 -0.769493
C -1.147235 2.027207 -1.261935
C 1.777422 0.103877 -0.392198
C -4.836180 1.177397 -0.431644
C -3.743887 -0.884628 0.231616
C -5.549893 0.019673 1.580434
C -5.673192 1.091885 0.683508
C -4.576999 -0.968203 1.345702
C 4.157637 0.523817 0.387277
C 0.745461 -1.983914 -0.799095
C -6.436117 -0.080366 2.778198
C 5.025575 1.589921 0.718054
C 4.603202 -0.803388 0.468266
C 6.328556 1.310838 1.125575
C 5.914558 -1.058529 0.879698
C 6.779276 -0.011918 1.208484
H -3.364661 0.971908 -2.636854
H -2.900979 -0.737646 -2.366307
H -1.784500 2.885220 -1.426203
H -4.941684 2.015910 -1.117772
H -2.985750 -1.652836 0.055030
H -6.421702 1.862832 0.855299
H -4.472209 -1.802312 2.037790
H 2.648127 1.921611 -0.042542
H -6.988224 -1.031476 2.790018
H -7.181422 0.723942 2.827371
H -5.851574 -0.034402 3.709183
H 4.689340 2.622706 0.658639
H 3.945426 -1.641834 0.216332
H 6.999784 2.130472 1.381182
H 6.260536 -2.090806 0.942532
H 7.797420 -0.222202 1.527309


%chk=000189901-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189901

0 1
Cl 0.921224 -3.776403 -0.809115
N -1.552022 0.727876 -1.401376
N 0.216249 2.069139 -0.800536
N -0.465555 -1.495770 -1.141630
N 2.892874 0.858906 -0.030515
N 1.871658 -1.293152 -0.427033
C -2.916906 0.301973 -1.800569
C -0.491795 -0.128364 -1.100526
C -3.885358 0.203421 -0.627938
C 0.588402 0.716835 -0.738742
C -1.072407 2.030367 -1.197603
C 1.819283 0.079441 -0.388693
C -4.911180 1.160247 -0.450919
C -3.774434 -0.860140 0.304705
C -5.697889 0.008830 1.579689
C -5.806015 1.063099 0.639586
C -4.666749 -0.950986 1.391076
C 4.216314 0.512768 0.356165
C 0.752700 -1.961774 -0.792726
C -6.652833 -0.099925 2.755881
C 5.090682 1.588895 0.673600
C 4.687954 -0.825283 0.435145
C 6.419155 1.333087 1.064832
C 6.022156 -1.062365 0.828774
C 6.895262 0.003374 1.145217
H -3.284758 1.020452 -2.554063
H -2.794658 -0.680299 -2.290693
H -1.699879 2.905455 -1.350935
H -5.019843 1.983946 -1.168150
H -2.989205 -1.614295 0.171223
H -6.597493 1.812283 0.759630
H -4.568132 -1.780469 2.101962
H 2.680927 1.862878 -0.053252
H -7.175716 -1.074296 2.759529
H -7.418076 0.694341 2.731570
H -6.112908 -0.018679 3.717875
H 4.728023 2.623358 0.613598
H 4.012285 -1.646448 0.191155
H 7.081318 2.171577 1.306472
H 6.379772 -2.096404 0.887327
H 7.928071 -0.196501 1.449005


