%chk=000296579.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296579

0 1
Cl 4.454336 2.783505 0.011050
S -0.809083 1.303948 -0.031372
O 1.023455 -3.115983 0.031174
N 1.253530 -0.349907 -0.047189
N 3.048578 -1.983045 -0.074761
N 3.595477 0.311640 -0.036881
N 1.460830 3.372066 -0.127623
C -1.602120 -0.323411 0.201689
C -3.059718 -0.031117 0.096200
C 0.904258 0.952814 -0.030869
C -3.691517 -0.035755 -1.158371
C -3.810033 0.248009 1.250209
C 1.846217 2.020231 -0.012190
C 2.595694 -0.644536 -0.051830
C -5.058763 0.234315 -1.253833
C -5.177299 0.516619 1.147553
C 3.203626 1.604686 -0.019213
C -5.803839 0.510450 -0.102734
C 2.225185 -3.153106 -0.044797
C 3.042256 -4.413596 -0.113991
H -1.305088 -0.766056 1.173997
H -1.237995 -1.047999 -0.561395
H -3.115195 -0.248604 -2.058226
H -3.327685 0.255174 2.226366
H -5.544779 0.229501 -2.228331
H -5.755792 0.731111 2.044715
H -6.868900 0.719622 -0.179989
H 4.072016 -2.084551 -0.112969
H 0.537391 3.587769 0.235624
H 2.143787 4.041785 0.210358
H 3.629854 -4.486691 -1.039651
H 2.373442 -5.291380 -0.091706
H 3.732174 -4.519207 0.734390


%chk=000296579-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296579

0 1
Cl 3.962782 2.826378 -1.458145
S -0.470440 1.790798 1.775031
O 0.244770 -2.904969 -0.020719
N 1.003961 -0.105853 0.427066
N 2.249466 -1.853954 -0.678309
N 2.925285 0.359708 -0.950259
N 1.555549 3.567043 0.310794
C -1.500443 0.176356 2.008937
C -2.598968 0.014061 0.988691
C 0.850384 1.214499 0.660210
C -2.461667 -0.951123 -0.042890
C -3.784625 0.792895 1.059411
C 1.717962 2.214574 0.089955
C 2.020179 -0.492972 -0.379643
C -3.496234 -1.124140 -0.991045
C -4.814151 0.619078 0.110104
C 2.758675 1.661274 -0.704659
C -4.671260 -0.341090 -0.920595
C 1.414091 -2.964905 -0.488842
C 2.055029 -4.291821 -0.896302
H -1.876600 0.296122 3.038042
H -0.756980 -0.634295 1.955955
H -1.553136 -1.562502 -0.089935
H -3.897494 1.538285 1.857174
H -3.384702 -1.874983 -1.781603
H -5.725743 1.224345 0.173311
H -5.470964 -0.478221 -1.657600
H 3.137156 -1.999750 -1.165546
H 0.749132 3.913608 0.825662
H 2.201142 4.226967 -0.117467
H 2.989119 -4.179527 -1.473258
H 1.329105 -4.869062 -1.491956
H 2.273920 -4.878523 0.013832


