%chk=000202932.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202932

0 1
Cl 0.907233 3.435525 -0.486686
S 2.653102 -1.654093 0.347018
N -1.010233 0.535726 -0.948233
N -3.559791 1.420241 0.093196
C 0.091589 -0.345310 -1.454950
C -2.243954 0.478982 -1.797543
C -1.377014 0.313484 0.485483
C -3.203070 1.603448 -1.353341
C -2.312215 1.456740 0.927962
C 1.403102 0.470551 -1.351424
C 0.096175 -1.751776 -0.866592
C 1.762941 0.901012 0.034152
C 1.089925 -2.346786 -0.088760
C -4.508863 2.487562 0.530633
C 2.317821 -0.030740 0.924178
C -1.040023 -2.535524 -1.177452
C 1.585423 2.208960 0.516924
C 0.965862 -3.668462 0.374893
C -1.169623 -3.846791 -0.731228
C 2.686076 0.301320 2.227080
C -0.158577 -4.422119 0.050099
C 1.950583 2.572107 1.817845
C 2.504339 1.615138 2.672391
H -0.063066 -0.489606 -2.567704
H -2.763566 -0.505176 -1.738241
H -1.957157 0.644983 -2.857202
H -0.454752 0.325398 1.103246
H -1.874751 -0.666833 0.657745
H -2.734820 2.590903 -1.560579
H -4.137291 1.544497 -1.950351
H -2.599109 1.307228 1.989641
H -1.771024 2.426627 0.859052
H 1.290656 1.356529 -2.018078
H 2.235662 -0.115141 -1.802675
H -4.791450 2.304581 1.579822
H -5.431201 2.414414 -0.067214
H -4.123850 3.514734 0.450312
H -1.843800 -2.099050 -1.776823
H 1.748705 -4.111675 0.995296
H -2.056205 -4.425864 -0.986324
H 3.110279 -0.450467 2.894517
H -0.255166 -5.446861 0.403725
H 1.803210 3.596729 2.161402
H 2.791091 1.892457 3.685589


%chk=000202932-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202932

0 1
Cl 0.926711 3.497562 -0.939600
S 2.599491 -1.662505 0.636952
N -1.069439 0.349099 -0.871542
N -3.471658 1.548213 0.174492
C 0.054269 -0.451035 -1.445472
C -2.225840 0.610651 -1.752974
C -1.502222 0.073939 0.516575
C -3.024788 1.812351 -1.214191
C -2.308874 1.270222 1.053199
C 1.390032 0.356813 -1.387595
C 0.105831 -1.898484 -0.914786
C 1.697520 0.938023 -0.028936
C 1.050749 -2.458932 -0.011313
C -4.326936 2.627261 0.703062
C 2.190521 0.093323 1.004194
C -0.944442 -2.752409 -1.361635
C 1.522324 2.299657 0.313731
C 0.936865 -3.811201 0.409370
C -1.059328 -4.095000 -0.956443
C 2.492869 0.575488 2.296149
C -0.105793 -4.632485 -0.061223
C 1.813978 2.817649 1.592316
C 2.305840 1.945172 2.587759
H -0.169840 -0.549409 -2.526633
H -2.918659 -0.265811 -1.819184
H -1.862457 0.846754 -2.770533
H -0.618633 -0.085725 1.157110
H -2.139631 -0.840369 0.579894
H -2.376053 2.723193 -1.273643
H -3.917225 1.977928 -1.847730
H -2.682589 1.034521 2.067913
H -1.629863 2.157462 1.128038
H 1.302229 1.173819 -2.122464
H 2.223824 -0.304334 -1.700348
H -4.685408 2.356268 1.712723
H -5.209464 2.757133 0.050536
H -3.801854 3.613835 0.775850
H -1.682914 -2.338528 -2.058771
H 1.671289 -4.212451 1.116279
H -1.880068 -4.714974 -1.332793
H 2.861114 -0.114389 3.061261
H -0.174668 -5.673033 0.273573
H 1.661759 3.880175 1.801603
H 2.534636 2.332164 3.586031


