%chk=000296247.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296247

0 1
S -1.147999 0.485456 1.118666
S 0.203930 -1.131551 -1.122969
O -0.607130 -0.600546 1.910146
O -1.013285 1.850107 1.569358
O 0.465003 -0.848903 -2.514084
O -0.830324 -2.073052 -0.747978
O -7.296420 -1.613414 -0.318774
O 6.428402 -2.386629 0.815897
O -7.672988 0.507753 -0.104367
O 5.381929 -3.031443 2.598117
N -0.313026 0.341959 -0.385921
N -6.943495 -0.468424 -0.100718
N 5.417381 -2.574640 1.469783
C 0.119066 1.609408 -1.045749
C 1.384112 2.190944 -0.394566
C 1.942721 3.348440 -1.231567
C 3.189051 3.957426 -0.575246
C 3.757871 5.110759 -1.413894
C -2.815168 0.189896 0.745180
C 1.701984 -1.539881 -0.350506
C 4.998871 5.719377 -0.765414
C -3.260921 -1.099866 0.452180
C 2.894497 -1.390607 -1.070911
C -3.710658 1.267638 0.768996
C 1.715564 -2.028434 0.956869
C -4.616092 -1.323858 0.172504
C 4.113849 -1.726531 -0.481429
C -5.062427 1.059808 0.492545
C 2.932819 -2.370441 1.561827
C -5.497491 -0.240161 0.196192
C 4.114890 -2.213855 0.833644
H 0.287734 1.420278 -2.135094
H -0.708817 2.353939 -0.992637
H 2.156565 1.410244 -0.266243
H 1.143893 2.549029 0.631484
H 2.189640 2.996657 -2.252404
H 1.168718 4.131093 -1.358119
H 2.941109 4.320990 0.441390
H 3.963822 3.179803 -0.434025
H 2.986255 5.893950 -1.550012
H 4.006725 4.751213 -2.431582
H 4.779268 6.120838 0.230706
H 5.800133 4.980483 -0.650593
H 5.397478 6.542898 -1.368866
H -2.556975 -1.952202 0.423450
H 2.874839 -1.016342 -2.103881
H -3.355385 2.278133 1.013541
H 0.777759 -2.137604 1.532694
H -4.979589 -2.331396 -0.063326
H 5.057291 -1.616779 -1.028138
H -5.778093 1.889625 0.505723
H 2.959110 -2.752586 2.589525


%chk=000296247-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296247

0 1
S -1.278441 0.692786 0.935532
S 0.310778 -1.183449 -1.279961
O -0.572104 -0.431287 1.875004
O -1.218259 2.268255 1.348779
O 0.771799 -0.956694 -2.823511
O -0.771899 -2.314823 -0.862475
O -7.524101 -1.818416 -0.189771
O 6.621405 -2.386486 1.025004
O -8.062115 0.291210 0.492837
O 5.434800 -2.986102 2.879539
N -0.646894 0.515216 -0.917839
N -7.210364 -0.636081 0.215407
N 5.517377 -2.545682 1.671528
C 0.090169 1.724899 -1.388095
C 1.402620 2.137765 -0.684205
C 1.978496 3.427872 -1.311090
C 3.305950 3.876012 -0.658098
C 3.876640 5.169264 -1.282953
C -3.104683 0.265063 0.664786
C 1.917781 -1.546360 -0.308631
C 5.203835 5.615176 -0.632317
C -3.440560 -1.020072 0.209301
C 3.120222 -1.390331 -1.019939
C -4.032045 1.273431 0.975482
C 1.823716 -2.019878 1.009293
C -4.811954 -1.315811 0.062026
C 4.319040 -1.724169 -0.357649
C -5.401156 0.969644 0.826913
C 3.027915 -2.352371 1.665419
C -5.761555 -0.317995 0.374813
C 4.247318 -2.194240 0.971888
H 0.261612 1.532082 -2.466402
H -0.649725 2.548252 -1.318378
H 2.150226 1.324737 -0.767633
H 1.209680 2.305550 0.392251
H 2.139964 3.274028 -2.398653
H 1.233099 4.244210 -1.215195
H 3.147560 4.033349 0.428739
H 4.057254 3.063722 -0.749861
H 3.126294 5.980486 -1.188612
H 4.030342 5.012366 -2.370197
H 5.070585 5.808354 0.448810
H 5.981058 4.835077 -0.739640
H 5.589884 6.541601 -1.095280
H -2.666496 -1.751731 -0.051478
H 3.111893 -1.045820 -2.058589
H -3.692579 2.253903 1.323015
H 0.856245 -2.111677 1.508802
H -5.148506 -2.292657 -0.293804
H 5.290757 -1.633972 -0.849359
H -6.179448 1.702830 1.052165
H 3.032567 -2.722036 2.693685


