%chk=000195251.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195251

0 1
S 2.687652 1.632620 0.079725
O -2.409939 1.417970 0.125137
O -0.094318 -2.530300 -0.103839
N -1.185720 -0.517534 0.011439
N -0.057380 1.656603 0.111117
C -2.589200 -1.007378 0.001568
C -3.392763 0.304270 0.078059
C -1.153155 0.892456 0.083911
C 0.026341 -1.330026 -0.043495
C 1.203329 -0.482631 -0.012725
C 1.107666 0.914335 0.060056
C 2.570763 -0.941951 -0.051267
C 3.473184 0.071519 -0.009055
H -2.771222 -1.683994 0.865154
H -2.791022 -1.591514 -0.923024
H -4.002076 0.517894 -0.815132
H -3.982675 0.423879 1.001276
H 2.805193 -1.999776 -0.108082
H 4.547542 0.006559 -0.024020


%chk=000195251-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195251

0 1
S 2.728004 1.691052 0.082765
O -2.430043 1.448626 0.128105
O -0.127343 -2.560649 -0.105640
N -1.188156 -0.470459 0.013630
N -0.061801 1.660948 0.112476
C -2.566230 -1.000577 0.002398
C -3.412136 0.309816 0.077799
C -1.149657 0.916496 0.085853
C -0.014086 -1.302483 -0.041976
C 1.202096 -0.494040 -0.013388
C 1.099613 0.917259 0.060767
C 2.562145 -0.969376 -0.052958
C 3.490769 0.051690 -0.010440
H -2.725179 -1.668357 0.864940
H -2.745026 -1.578680 -0.919025
H -4.039707 0.469789 -0.812261
H -4.023670 0.376247 0.990651
H 2.815420 -2.029960 -0.110779
H 4.577187 -0.014341 -0.026114


