%chk=000238939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238939

0 1
S -1.888894 -1.583888 0.000079
O -4.106211 1.696665 0.000480
O -4.755341 -0.451499 -0.000257
O 4.605213 -0.177625 0.000052
O 3.752035 1.811179 -0.000506
N 3.661572 0.594462 -0.000050
C -0.082921 0.287478 0.000027
C -0.211487 -1.127164 0.000063
C -1.367714 0.960765 0.000020
C 1.196761 0.865758 0.000000
C 0.902903 -1.974849 0.000077
C -2.410833 0.088211 0.000056
C 2.300259 0.012923 -0.000004
C 2.164295 -1.398910 0.000038
C -3.844823 0.343116 0.000055
H -1.462190 2.043948 0.000008
H 1.328596 1.953846 -0.000054
H 0.783048 -3.059238 0.000094
H 3.069720 -2.018621 0.000043
H -5.085288 1.889145 0.000480


%chk=000238939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238939

0 1
S -1.939590 -1.672872 0.000051
O -4.113031 1.765528 0.000125
O -4.806204 -0.463179 0.000045
O 4.683867 -0.198261 -0.000623
O 3.770528 1.891867 -0.000522
N 3.672114 0.604124 0.000205
C -0.090168 0.285458 0.000110
C -0.215370 -1.147466 0.000074
C -1.371777 0.951742 0.000131
C 1.202480 0.866684 0.000123
C 0.915310 -1.993842 0.000059
C -2.442655 0.077127 0.000088
C 2.312464 0.007442 0.000115
C 2.192851 -1.409834 0.000079
C -3.878768 0.381879 0.000074
H -1.507117 2.035193 0.000161
H 1.350614 1.949906 0.000163
H 0.807905 -3.082342 0.000039
H 3.100404 -2.018248 0.000079
H -5.095159 1.924795 0.000123


