%chk=000250767.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250767

0 1
S -1.566418 -1.589600 1.235930
O -2.888920 -0.428862 -0.659088
O 3.170809 0.593584 -1.343267
O -1.986807 -2.801533 0.525339
O 0.983158 -2.952535 0.615113
O -2.993441 2.029051 1.510824
N 1.145269 1.000128 -0.330606
N 2.076404 -1.241000 -0.429979
N -0.974337 1.433389 0.721624
C -0.009342 0.498534 0.292857
C -0.132693 -0.848816 0.528488
C 1.359387 2.459799 -0.583597
C -2.815171 -0.277112 0.740557
C 2.226451 0.113580 -0.748928
C 0.928156 -1.791797 0.280138
C -2.338583 1.121520 1.053648
C 1.889728 3.173701 0.668365
C 3.216614 -2.156097 -0.778732
C 1.925138 4.681877 0.452082
C 4.337968 -2.056279 0.246796
C -4.159097 -0.018652 -1.265344
C -3.945331 -0.334010 -2.732136
H 2.102348 2.558981 -1.418888
H 0.418934 2.916149 -0.960092
H -3.776976 -0.487485 1.252704
H -0.720059 2.432083 0.770320
H 1.281233 2.931224 1.560930
H 2.910426 2.800931 0.901692
H 2.809079 -3.195824 -0.819534
H 3.583626 -1.888617 -1.795944
H 2.562934 4.957459 -0.397882
H 0.929085 5.099877 0.266676
H 2.331660 5.195147 1.333660
H 5.150644 -2.751651 0.001701
H 4.770122 -1.047640 0.281843
H 3.989205 -2.307906 1.256907
H -4.969429 -0.617194 -0.815031
H -4.317338 1.053558 -1.066832
H -4.877595 -0.252967 -3.301403
H -3.201804 0.330422 -3.188921
H -3.562837 -1.361318 -2.853187


%chk=000250767-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250767

0 1
S -1.803329 -1.564089 1.156083
O -3.000813 0.242415 -0.686698
O 3.228437 0.742162 -1.194216
O -2.380818 -2.490554 -0.105279
O 0.752690 -2.951136 0.296360
O -2.801812 2.195268 2.083880
N 1.133096 1.117697 -0.215363
N 1.972561 -1.113654 -0.507855
N -0.909122 1.581945 0.897690
C -0.027221 0.610231 0.381000
C -0.222691 -0.755466 0.489949
C 1.342307 2.576470 -0.447637
C -2.947906 0.196647 0.706922
C 2.183711 0.258469 -0.673721
C 0.808300 -1.703197 0.100828
C -2.242575 1.385400 1.293994
C 2.012381 3.303630 0.742479
C 3.067672 -2.032564 -0.933904
C 2.247325 4.794078 0.417819
C 4.110450 -2.243358 0.180122
C -4.177563 -0.436870 -1.340567
C -3.719506 -0.902760 -2.715488
H 2.007280 2.651195 -1.323408
H 0.372075 3.032131 -0.715801
H -3.891392 -0.018177 1.234179
H -0.511863 2.474011 1.209531
H 1.401297 3.215493 1.665232
H 2.975693 2.805755 0.955854
H 2.585089 -2.987393 -1.196802
H 3.535536 -1.588651 -1.827302
H 2.901354 4.906328 -0.466102
H 1.297125 5.319601 0.206570
H 2.734969 5.308304 1.264111
H 4.894468 -2.936592 -0.173973
H 4.594832 -1.290004 0.453206
H 3.641710 -2.685717 1.075509
H -4.482972 -1.291448 -0.714829
H -4.983832 0.321190 -1.393595
H -4.571604 -1.350435 -3.259637
H -3.332161 -0.059152 -3.312908
H -2.930980 -1.663105 -2.597432


