%chk=000296441.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296441

0 1
S 3.484382 2.059281 -0.208180
O 1.818431 -1.620072 0.173669
N -0.201551 -0.584913 0.100427
N 0.712465 0.429499 -0.011147
N -1.661768 -2.248921 0.283179
N -0.446884 -2.849567 0.325015
C -1.587006 -0.887822 0.149236
C 0.470472 -1.864004 0.216052
C -2.691027 0.060754 0.071906
C 1.904047 -0.173971 0.031345
C 3.226636 0.348245 -0.037847
C -4.009524 -0.429103 0.138369
C -2.461475 1.440216 -0.066339
C 4.429220 -0.319061 0.010559
C -5.083936 0.458832 0.066550
C -3.545144 2.318794 -0.137135
C -4.854604 1.832039 -0.071098
C 5.554935 0.565075 -0.091168
C 5.201372 1.880665 -0.214505
H -4.187052 -1.502897 0.245957
H -1.444446 1.832675 -0.118999
H 4.531219 -1.394602 0.113979
H -6.103706 0.078557 0.118119
H -3.366550 3.387998 -0.244327
H -5.695822 2.521661 -0.126785
H 6.574419 0.198299 -0.069514
H 5.856696 2.733841 -0.306718


%chk=000296441-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296441

0 1
S 3.414712 2.151723 -0.219775
O 1.807988 -1.650692 0.182467
N -0.213932 -0.666367 0.113851
N 0.695430 0.407964 -0.003043
N -1.715712 -2.296982 0.289406
N -0.412387 -2.922702 0.334870
C -1.582406 -0.937045 0.156793
C 0.430665 -1.893101 0.224562
C -2.672878 0.032784 0.075707
C 1.884926 -0.211079 0.040210
C 3.194648 0.365639 -0.036453
C -4.015391 -0.434135 0.131484
C -2.415175 1.425462 -0.056994
C 4.419843 -0.301857 0.010457
C -5.082180 0.481538 0.055184
C -3.492054 2.333740 -0.132548
C -4.826087 1.868337 -0.077115
C 5.547285 0.578996 -0.096978
C 5.190157 1.914827 -0.225927
H -4.194855 -1.508930 0.233941
H -1.384063 1.791082 -0.099822
H 4.491224 -1.386449 0.117741
H -6.114288 0.117147 0.098370
H -3.289744 3.405533 -0.234745
H -5.658667 2.577904 -0.136307
H 6.584819 0.239295 -0.080169
H 5.831922 2.788865 -0.324567


