%chk=000289290.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289290

0 1
S -2.847924 0.269368 0.387817
O -3.911312 -0.000166 -0.556508
O -3.179664 0.838797 1.670304
O 2.303043 0.870470 -0.028556
O 2.285471 -1.023762 1.260713
N 0.289621 -0.029385 0.531233
C -0.613059 -1.033152 -0.117189
C -0.449275 0.388747 -0.700486
C -1.911705 -1.237587 0.605137
C -1.625928 1.281062 -0.435749
C 1.701965 -0.178445 0.627683
C 3.747777 1.043522 0.161937
C 4.507891 0.002736 -0.629759
H -0.187015 -1.916330 -0.608596
H 0.104085 0.576137 -1.629438
H -2.458764 -2.124467 0.228909
H -1.740096 -1.456497 1.684231
H -1.333804 2.154054 0.190940
H -2.020409 1.730644 -1.368190
H 3.874296 2.071968 -0.225560
H 3.963139 1.001038 1.244400
H 5.588083 0.194770 -0.608564
H 4.348839 -1.006567 -0.217607
H 4.195346 -0.020656 -1.681002


%chk=000289290-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289290

0 1
S -3.068516 0.259753 0.219805
O -3.941085 -0.298826 -1.041446
O -3.804587 1.021933 1.454511
O 2.383653 0.917393 0.137096
O 2.287491 -1.189136 1.189712
N 0.342889 -0.027195 0.539200
C -0.615318 -1.047981 0.076728
C -0.430464 0.339659 -0.665610
C -1.877544 -1.216626 0.862106
C -1.537543 1.331810 -0.502080
C 1.731869 -0.203636 0.650069
C 3.874627 0.921914 0.286150
C 4.541500 0.155523 -0.858089
H -0.218738 -1.928191 -0.442130
H 0.076514 0.298888 -1.636091
H -2.441607 -2.129941 0.630414
H -1.786670 -1.011557 1.937078
H -1.374532 2.086439 0.279012
H -1.925259 1.744088 -1.443315
H 4.125005 1.994348 0.272967
H 4.127051 0.482737 1.267029
H 5.640025 0.251668 -0.777063
H 4.287819 -0.916813 -0.811951
H 4.234020 0.560049 -1.838003


