%chk=000201260.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201260

0 1
S 4.770527 -0.224185 -0.719466
O -1.079937 -0.127114 0.036049
O -1.764926 -2.115651 -0.924084
O -2.645906 1.340516 0.982085
N -3.303811 -0.624605 -0.001516
C 2.399983 0.845707 0.185677
C 3.034854 -0.237442 -0.454181
C 0.299666 -0.277841 -0.189141
C 1.005861 0.820756 0.320642
C 2.306397 -1.317961 -0.954500
C 0.913905 -1.354506 -0.827539
C 3.175164 2.001609 0.717801
C -2.002760 -1.072509 -0.361731
C -4.414234 -1.541321 -0.378382
C -3.565304 0.618679 0.679067
C -5.004711 0.918846 0.962651
C 5.411055 -1.013618 0.779736
H 0.457207 1.628618 0.806512
H 2.817856 -2.145574 -1.452859
H 0.337326 -2.196062 -1.217223
H 3.826059 1.698750 1.551641
H 3.833989 2.435383 -0.052803
H 2.532549 2.812591 1.085744
H -4.020965 -2.445712 -0.887883
H -5.109205 -1.045371 -1.075104
H -4.962051 -1.878101 0.516449
H -5.472024 0.168373 1.615758
H -5.086770 1.891022 1.480288
H -5.609088 0.992064 0.047410
H 5.037785 -2.037281 0.887252
H 5.150608 -0.449902 1.680458
H 6.504304 -1.049658 0.693494


%chk=000201260-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201260

0 1
S 4.914816 -0.373635 -0.827610
O -1.119861 -0.100304 -0.182415
O -1.863102 -2.232309 -0.836909
O -2.697890 1.025664 1.627496
N -3.349511 -0.641564 0.063583
C 2.454322 0.772013 0.117088
C 3.084064 -0.307592 -0.572211
C 0.287858 -0.286773 -0.353287
C 1.043027 0.757321 0.218018
C 2.307745 -1.342557 -1.142930
C 0.898355 -1.351338 -1.050624
C 3.238237 1.911822 0.737934
C -2.063796 -1.097637 -0.340916
C -4.490079 -1.478503 -0.394379
C -3.592011 0.471332 0.945200
C -5.048079 0.927394 1.012884
C 5.491446 -0.821651 0.918521
H 0.509043 1.556736 0.741119
H 2.816853 -2.155600 -1.669863
H 0.306426 -2.155718 -1.487312
H 3.509330 1.684842 1.787601
H 4.176441 2.089946 0.184194
H 2.644737 2.841805 0.749520
H -4.080802 -2.319077 -0.972417
H -5.172980 -0.895049 -1.034656
H -5.051092 -1.886402 0.463442
H -5.700477 0.156131 1.460890
H -5.083658 1.826960 1.644124
H -5.449777 1.166488 0.011999
H 5.017661 -1.762329 1.236401
H 5.252625 -0.011018 1.623420
H 6.583531 -0.950899 0.854400


