%chk=000260091.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260091

0 1
S -3.688243 0.320739 1.993274
S -6.577337 0.158410 1.210630
O -2.475663 -0.380993 -1.582938
N 2.342911 -0.078767 0.093018
N -4.443707 -0.156101 -0.417515
C 1.389815 0.123787 1.096022
C 0.108432 0.009408 0.502069
C 1.671235 -0.323466 -1.143563
C 0.312969 -0.268306 -0.894529
C 3.774520 -0.038439 0.264588
C -1.115109 0.159431 1.229320
C 1.739155 0.389625 2.506246
C -2.395919 0.080911 0.811224
C 2.395722 -0.568682 -2.405842
C -2.982472 -0.178473 -0.504668
C 4.389165 1.154731 0.678632
C 4.532184 -1.192977 0.009516
C -5.262789 -0.458061 -1.630955
C -5.006460 0.077964 0.815743
C 5.776395 1.182760 0.839209
C 5.918606 -1.143963 0.172367
C -5.637661 -1.933818 -1.690502
C 6.540741 0.038459 0.587111
H -0.475575 -0.407142 -1.619995
H -0.957106 0.374911 2.305344
H 1.515087 1.432577 2.783576
H 1.168633 -0.260974 3.189151
H 2.803120 0.218095 2.732076
H 2.707311 -1.620339 -2.497688
H 1.753885 -0.347698 -3.274464
H 3.296296 0.055026 -2.505644
H -6.174678 0.183519 -1.618206
H -4.658271 -0.170919 -2.525042
H 3.791771 2.047477 0.862831
H 4.042683 -2.113826 -0.307804
H 6.264214 2.103978 1.159043
H 6.516734 -2.034457 -0.023238
H -4.751138 -2.579835 -1.716732
H -6.240371 -2.237059 -0.822913
H -6.229425 -2.148311 -2.588383
H 7.622539 0.068499 0.712932


%chk=000260091-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260091

0 1
S -3.737895 0.262218 2.113822
S -6.718920 0.117252 1.288850
O -2.536655 -0.407306 -1.610183
N 2.358388 -0.094078 0.060618
N -4.517846 -0.173870 -0.360477
C 1.394324 0.091965 1.051016
C 0.115048 -0.032954 0.425137
C 1.724498 -0.338440 -1.196473
C 0.355067 -0.299062 -0.984890
C 3.786601 -0.038246 0.264342
C -1.106522 0.100749 1.173770
C 1.760915 0.349641 2.485545
C -2.443491 0.031616 0.816109
C 2.507924 -0.539684 -2.461329
C -3.084944 -0.202954 -0.485668
C 4.405067 1.191929 0.591319
C 4.562840 -1.213751 0.128803
C -5.352255 -0.413616 -1.563674
C -5.077732 0.045636 0.892279
C 5.802905 1.242808 0.787871
C 5.961385 -1.154555 0.318149
C -5.708501 -1.903682 -1.728511
C 6.584040 0.071708 0.649224
H -0.426026 -0.431065 -1.728916
H -0.941914 0.302144 2.243266
H 1.950561 1.422170 2.685992
H 0.950414 0.028614 3.160550
H 2.673496 -0.201521 2.773664
H 3.094168 -1.478031 -2.457951
H 1.809337 -0.584665 -3.312340
H 3.219243 0.287666 -2.645802
H -6.264665 0.196897 -1.453230
H -4.762556 -0.057348 -2.425165
H 3.793865 2.096623 0.676886
H 4.069044 -2.162133 -0.107475
H 6.280940 2.195460 1.039886
H 6.561497 -2.064926 0.214828
H -4.796553 -2.514711 -1.841202
H -6.283418 -2.267019 -0.859687
H -6.327780 -2.038000 -2.633624
H 7.668305 0.114226 0.797975


