%chk=000218690.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218690

0 1
S -2.711308 1.360904 0.507455
N -1.763794 -1.125952 0.666047
C -1.289840 0.232453 0.973635
C -0.073843 0.650695 0.150706
C 1.176114 -0.135270 0.574731
C -2.630592 -1.102819 -0.547018
C 2.407037 0.298343 -0.231003
C -3.559146 0.118621 -0.525281
C 3.656006 -0.490987 0.186358
C 4.886395 -0.064567 -0.611306
H -1.096826 0.355591 2.065551
H 0.104260 1.738736 0.272139
H -0.259767 0.498576 -0.931689
H 1.364278 0.002743 1.656208
H 0.991558 -1.220434 0.435804
H -2.280174 -1.518865 1.462965
H -3.202655 -2.051263 -0.611898
H -1.967529 -1.072096 -1.442199
H 2.219697 0.157211 -1.312923
H 2.586405 1.382346 -0.096647
H -3.731176 0.532630 -1.532792
H -4.545205 -0.105482 -0.084740
H 3.845555 -0.351362 1.268601
H 3.478403 -1.575673 0.048278
H 4.746316 -0.225924 -1.686195
H 5.772104 -0.633251 -0.306978
H 5.112926 0.997896 -0.466809


%chk=000218690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218690

0 1
S -2.837195 1.472546 0.437657
N -1.789626 -1.086265 0.643506
C -1.329873 0.259882 0.944067
C -0.072096 0.687968 0.172518
C 1.184630 -0.109827 0.592352
C -2.599656 -1.083331 -0.595343
C 2.440408 0.290366 -0.214560
C -3.671787 0.048965 -0.497307
C 3.700735 -0.509213 0.188342
C 4.950790 -0.114719 -0.627733
H -1.189653 0.384137 2.031389
H 0.091155 1.769442 0.347534
H -0.248263 0.576464 -0.914745
H 1.379333 0.048587 1.674431
H 0.981700 -1.190788 0.463177
H -2.310368 -1.499130 1.429478
H -3.067552 -2.072751 -0.740225
H -1.939221 -0.887401 -1.457387
H 2.244330 0.140228 -1.297069
H 2.637936 1.375019 -0.082765
H -3.975571 0.410306 -1.492782
H -4.559267 -0.278714 0.070030
H 3.899066 -0.356176 1.268959
H 3.499550 -1.592410 0.060082
H 4.788267 -0.286900 -1.708608
H 5.837118 -0.700480 -0.321645
H 5.190309 0.956995 -0.492354


