%chk=000242450.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242450

0 1
S -0.954326 -3.387130 -0.504252
O 3.233812 0.161274 0.426545
O 2.991909 0.637972 -1.781363
N -2.129233 1.447353 0.612775
N -1.552703 -0.796875 -0.026869
N 0.747807 -1.381453 -0.563729
C -3.580479 1.348984 0.285051
C -2.743396 2.487708 -0.265640
C -1.177967 0.516222 0.109755
C 0.160050 0.930456 -0.108005
C 1.077980 -0.068581 -0.443053
C -0.566817 -1.686213 -0.340249
C 2.518005 0.276031 -0.735202
C -2.707530 -3.471866 -0.110000
C 4.663550 0.419764 0.335398
H -4.256068 1.512327 1.132139
H -3.949242 0.558292 -0.375720
H -2.505309 2.534204 -1.330875
H -2.803763 3.488351 0.177557
H 0.450862 1.972021 0.005002
H -3.320605 -2.921624 -0.835747
H -2.928428 -3.058131 0.884399
H -3.003246 -4.529135 -0.124473
H 4.966043 0.429472 1.388498
H 4.844634 1.381208 -0.155211
H 5.136161 -0.398434 -0.217532


%chk=000242450-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242450

0 1
S -0.762637 -3.424064 -0.007355
O 3.400669 -0.410444 -0.140953
O 2.752992 1.823889 -0.083749
N -2.395446 1.401225 0.373835
N -1.580345 -0.804365 0.128424
N 0.814454 -1.260630 -0.030308
C -3.712135 1.318411 -0.289249
C -2.802035 2.543533 -0.483625
C -1.318094 0.540531 0.181850
C 0.014403 1.041618 0.117085
C 1.046326 0.088251 0.005919
C -0.497431 -1.626802 0.039134
C 2.462303 0.600259 -0.076495
C -2.635003 -3.505932 0.143071
C 4.812073 0.039694 -0.220695
H -4.583457 1.391835 0.368424
H -3.810025 0.613492 -1.123127
H -2.303057 2.654647 -1.454785
H -3.030871 3.477815 0.037975
H 0.242876 2.108042 0.158910
H -3.102962 -3.011820 -0.719678
H -2.955798 -3.015242 1.072374
H -2.879015 -4.579834 0.160486
H 5.394096 -0.890270 -0.270953
H 5.074742 0.629729 0.673520
H 4.965079 0.658629 -1.120836


