%chk=000234400.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234400

0 1
S -1.754421 -1.713576 -0.060626
O -1.739110 -2.429978 1.212980
O -1.947881 -2.454774 -1.303731
O 6.628329 0.815951 -0.915812
N 3.352612 1.279946 -0.526304
N 5.158205 0.155509 0.751627
N -5.904945 2.500364 0.234794
N 6.846058 -1.323266 -0.103908
C -0.263736 -0.845939 -0.186881
C -2.971602 -0.493695 0.026826
C 0.472614 -0.545077 0.962921
C 0.234278 -0.475463 -1.442788
C 2.174061 0.528343 -0.387676
C 1.683158 0.136917 0.880114
C 1.438006 0.208166 -1.557578
C -3.590283 -0.031905 -1.142016
C -3.374628 0.011724 1.269346
C -4.578473 0.943459 -1.088795
C -4.359913 0.987640 1.357322
C -4.965375 1.468040 0.169525
C 4.347463 1.388903 0.559663
C 6.241428 -0.052664 -0.148996
H 0.099726 -0.861373 1.945127
H -0.323951 -0.740445 -2.348736
H 2.230395 0.374384 1.786634
H 1.810860 0.492731 -2.537786
H -3.301112 -0.454040 -2.112286
H -2.916711 -0.375875 2.187391
H 3.737678 1.376364 -1.469537
H -5.046013 1.299172 -2.001456
H -4.659565 1.377229 2.324962
H 3.840455 1.613286 1.531243
H 5.038845 2.238912 0.307990
H 4.639991 -0.658122 1.087968
H -6.482548 2.688238 -0.567805
H -6.332591 2.718136 1.119488
H 7.732837 -1.415040 -0.587278
H 6.748757 -1.921080 0.701075


%chk=000234400-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234400

0 1
S -1.800559 -1.703217 -0.121172
O -1.770557 -2.493956 1.318514
O -2.021373 -2.457467 -1.562710
O 6.545076 0.579337 -1.188243
N 3.536798 1.193438 -0.564414
N 5.355325 0.189215 0.781528
N -6.254153 2.406250 0.318032
N 7.084958 -1.279924 0.118223
C -0.167826 -0.778689 -0.247130
C -3.152574 -0.404322 0.013226
C 0.554391 -0.527967 0.929900
C 0.322022 -0.433882 -1.520279
C 2.321575 0.518339 -0.432652
C 1.800944 0.120760 0.838095
C 1.562614 0.218460 -1.607980
C -3.764299 0.056522 -1.165559
C -3.562065 0.013105 1.291514
C -4.801641 1.000386 -1.062398
C -4.599827 0.956786 1.392702
C -5.229405 1.470267 0.217339
C 4.514719 1.368853 0.505444
C 6.343296 -0.136957 -0.156521
H 0.158098 -0.865097 1.893850
H -0.245466 -0.700541 -2.418027
H 2.361035 0.315514 1.757975
H 1.962494 0.496060 -2.590518
H -3.450239 -0.341075 -2.136503
H -3.093405 -0.417022 2.183030
H 3.918683 1.297095 -1.507052
H -5.293211 1.371153 -1.969458
H -4.935702 1.293988 2.380342
H 4.012586 1.661557 1.441737
H 5.188977 2.183384 0.198126
H 5.039813 -0.498471 1.466915
H -6.717241 2.764296 -0.512170
H -6.575939 2.732406 1.224637
H 7.790269 -1.546745 -0.563896
H 7.004709 -1.810741 0.982552


