%chk=000295921.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295921

0 1
S 2.838841 -1.776074 -0.219973
O -1.445316 0.906567 0.006180
N 0.547327 -0.351860 -0.099846
N 2.666605 0.842332 -0.011215
C -0.094979 0.854263 -0.001939
C -2.180546 -0.373333 -0.093113
C 0.592109 2.087389 0.094155
C 1.914062 -0.291368 -0.099115
C 1.986913 2.023241 0.084823
C -3.610029 0.060201 -0.052225
C 1.587459 -3.066186 -0.318758
C -4.626261 -0.795239 -0.116314
H -1.891385 -0.860677 -1.042373
H -1.883691 -1.005614 0.763822
H 0.047258 3.022088 0.170246
H 2.605305 2.927662 0.154863
H -3.750392 1.143137 0.035069
H 0.936827 -2.941758 -1.194540
H 0.943215 -3.083025 0.570293
H 2.107038 -4.029931 -0.397829
H -5.661220 -0.481355 -0.086756
H -4.514340 -1.866760 -0.202556


%chk=000295921-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295921

0 1
S 2.867908 -1.822766 -0.230500
O -1.428959 0.950807 0.014599
N 0.578361 -0.297865 -0.096398
N 2.728818 0.847203 -0.016496
C -0.051556 0.901778 0.003704
C -2.160706 -0.342523 -0.090442
C 0.653247 2.130748 0.099055
C 1.944765 -0.263876 -0.101469
C 2.057011 2.037190 0.083191
C -3.631935 0.003451 -0.053636
C 1.456772 -3.061035 -0.314363
C -4.632815 -0.906318 -0.129630
H -1.862278 -0.843267 -1.030428
H -1.853073 -0.993630 0.749065
H 0.125404 3.081795 0.178941
H 2.682288 2.933260 0.151516
H -3.855320 1.073710 0.041824
H 0.833527 -2.861257 -1.197222
H 0.847371 -2.997568 0.597961
H 1.938648 -4.048192 -0.393026
H -5.681783 -0.595571 -0.097552
H -4.440895 -1.982372 -0.225793


