%chk=000219438.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219438

0 1
S -0.393207 1.180756 1.280000
S -0.010380 -1.282049 -0.420333
O -5.059912 0.578361 -0.444491
N 1.953735 0.250218 0.489178
N -3.672076 -1.120270 -1.018164
C 2.939267 -0.626595 -0.221511
C 2.544907 1.383667 1.262857
C 0.634811 0.012510 0.416899
C 3.374837 -1.787911 0.663894
C 2.598353 2.658186 0.428011
C -2.081848 0.535238 1.110818
C -2.685369 0.989574 -0.205458
C -3.917034 0.165207 -0.549118
H 2.487710 -1.011522 -1.170655
H 3.811605 -0.003330 -0.519630
H 1.975903 1.550017 2.208822
H 3.571333 1.090293 1.586834
H 3.829280 -1.456186 1.603210
H 2.521325 -2.434665 0.923246
H 4.104815 -2.420678 0.143679
H 3.189784 2.530242 -0.486883
H 1.597961 2.992837 0.117170
H 3.047622 3.480551 0.999297
H -2.083807 -0.573074 1.214467
H -2.651249 0.932949 1.978515
H -1.949432 0.926765 -1.039038
H -2.984115 2.060355 -0.159042
H -4.439746 -1.725639 -1.260603
H -2.741669 -1.504008 -1.099772


%chk=000219438-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219438

0 1
S -0.414974 1.244241 1.385616
S -0.070226 -1.343043 -0.385575
O -5.166622 0.574199 -0.605874
N 1.950891 0.256538 0.505504
N -3.646459 -1.160459 -0.948189
C 2.919135 -0.606229 -0.230220
C 2.553145 1.381387 1.276209
C 0.607904 -0.000189 0.454068
C 3.404644 -1.797935 0.619242
C 2.703725 2.667937 0.436980
C -2.153086 0.563218 1.108479
C -2.757257 1.006651 -0.241597
C -3.976601 0.141800 -0.613519
H 2.421068 -0.972256 -1.143819
H 3.767632 0.038234 -0.526522
H 1.938749 1.573519 2.173273
H 3.540824 1.034342 1.631138
H 3.887821 -1.460767 1.554384
H 2.555049 -2.452834 0.875189
H 4.141349 -2.391190 0.047841
H 3.331715 2.492930 -0.454991
H 1.718819 3.035927 0.103903
H 3.182822 3.458419 1.042582
H -2.056344 -0.532922 1.175725
H -2.734517 0.937279 1.967518
H -1.992114 0.904671 -1.032079
H -3.084667 2.057301 -0.197070
H -4.390270 -1.810328 -1.200545
H -2.668752 -1.468643 -0.945452


