%chk=000299295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299295

0 1
S -1.355376 0.341828 1.251255
S -0.944776 0.486279 -1.764561
O 0.473650 -2.409022 -0.226958
O 0.457882 1.721171 0.020595
N 1.408910 -0.379994 0.124838
C -1.100237 -0.583153 -0.297744
C -2.248185 -1.596083 -0.498357
C 0.276680 -1.209868 -0.146410
C 2.727908 -1.082471 0.264504
C 3.774881 -0.419376 -0.637587
C 3.931374 1.080929 -0.347061
C -2.686983 1.520041 0.866737
C -2.346231 1.639034 -1.638957
C -2.336166 2.397440 -0.322729
C 2.806191 1.635784 0.532667
C 1.449442 1.052829 0.193760
C -2.073967 -2.411346 -1.785821
C -2.379430 -2.551337 0.694723
H -3.199802 -1.009327 -0.583049
H 2.608841 -2.160723 -0.004189
H 3.036047 -1.049732 1.331951
H 3.488453 -0.565600 -1.699549
H 4.744077 -0.939201 -0.515703
H 3.960403 1.639281 -1.304311
H 4.903802 1.276506 0.145000
H -2.807668 2.127571 1.787871
H -3.636588 0.974300 0.714268
H -3.294863 1.093059 -1.796303
H -2.225420 2.331595 -2.498087
H -3.055143 3.243227 -0.380283
H -1.335743 2.874014 -0.164458
H 2.748683 2.740564 0.433878
H 3.019157 1.443522 1.605556
H -1.133205 -2.982353 -1.769350
H -2.885845 -3.136727 -1.901997
H -2.064873 -1.786692 -2.685041
H -1.460987 -3.141220 0.833285
H -3.195589 -3.263957 0.536438
H -2.582304 -2.029193 1.635577


%chk=000299295-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299295

0 1
S -1.611688 0.307744 1.427352
S -0.940657 0.602944 -1.756273
O 0.466946 -2.363940 0.122140
O 0.633984 1.972311 0.353759
N 1.461547 -0.271003 0.236301
C -1.119994 -0.560509 -0.226802
C -2.173587 -1.678767 -0.570748
C 0.302167 -1.111759 0.057129
C 2.757955 -1.018760 0.388915
C 3.791887 -0.548901 -0.654013
C 3.934035 1.003677 -0.648574
C -2.930105 1.558263 0.900131
C -2.415077 1.775240 -1.588326
C -2.500445 2.495548 -0.236161
C 3.040249 1.628255 0.454205
C 1.585517 1.157110 0.351003
C -1.826344 -2.494699 -1.844297
C -2.502997 -2.650144 0.592850
H -3.098497 -1.100538 -0.789076
H 2.531803 -2.088225 0.275454
H 3.136232 -0.865174 1.416728
H 3.482465 -0.907740 -1.651818
H 4.756356 -1.037425 -0.420878
H 3.631691 1.418998 -1.626818
H 4.983023 1.308863 -0.483869
H -3.102761 2.119327 1.835214
H -3.855577 1.011455 0.642559
H -3.342610 1.214320 -1.805170
H -2.238565 2.490298 -2.410826
H -3.264773 3.296230 -0.324841
H -1.532664 2.966030 0.004951
H 3.015989 2.727659 0.383051
H 3.442556 1.372275 1.454573
H -0.959810 -3.150009 -1.657441
H -2.690544 -3.131415 -2.110667
H -1.604153 -1.837892 -2.702209
H -1.634924 -3.288208 0.823800
H -3.343314 -3.301348 0.286431
H -2.798312 -2.108491 1.506658


