%chk=000259185.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259185

0 1
S -3.614477 1.571773 0.218616
O 1.199484 -2.010707 0.748309
O 2.086667 2.007565 -0.136164
O 4.124717 1.547662 0.673163
N -1.450334 -2.554559 0.108090
N 1.483621 -0.435513 -0.880998
C -0.806969 -1.347374 -0.460290
C -1.494720 -0.067257 0.063630
C -2.945990 -0.011253 -0.392394
C 0.696816 -1.294318 -0.099292
C 2.889014 -0.209049 -0.511768
C -5.389024 1.368815 -0.050281
C 3.146158 1.157027 0.089289
H -0.914957 -1.407409 -1.577910
H -1.438407 -0.036172 1.174150
H -0.940724 0.828311 -0.287854
H -3.035403 -0.061501 -1.492124
H -3.523407 -0.866119 0.013012
H -1.436755 -2.527275 1.127090
H -0.943321 -3.394875 -0.166513
H 1.060177 0.299446 -1.447004
H 3.539838 -0.331452 -1.414193
H 3.224693 -0.996246 0.224470
H -5.798768 0.539235 0.535842
H -5.628258 1.209440 -1.106621
H -5.883952 2.293843 0.276322
H 2.230983 2.912263 0.256125


%chk=000259185-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259185

0 1
S -4.157298 1.100691 1.007463
O 0.946482 -1.951905 0.994573
O 2.986448 1.740019 -1.414799
O 4.892070 1.268936 -0.165049
N -1.417190 -2.385606 -0.581146
N 1.492625 -0.121246 -0.318676
C -0.819094 -1.042783 -0.477676
C -1.703503 -0.128157 0.421564
C -3.103725 0.063695 -0.178971
C 0.612742 -1.087630 0.124193
C 2.850375 -0.043642 0.222042
C -5.784562 1.030022 0.064764
C 3.701434 1.024838 -0.437685
H -0.778155 -0.602213 -1.494666
H -1.783529 -0.592767 1.423734
H -1.207818 0.853189 0.555272
H -3.053340 0.595617 -1.147287
H -3.586394 -0.915943 -0.326106
H -1.306189 -2.898031 0.305426
H -1.032068 -2.937763 -1.356997
H 1.227114 0.560977 -1.032025
H 3.369741 -1.015901 0.115594
H 2.835469 0.157403 1.311784
H -6.119892 -0.014502 -0.040192
H -5.675680 1.496608 -0.927916
H -6.520126 1.595422 0.658024
H 3.570767 2.434974 -1.820543


