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	hartrees
Energy at 0K	-491.477909
Energy at 298.15K	-491.473447
HF Energy	-491.648498
Nuclear repulsion energy	79.810555

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3699	3569	239.49
2	A'	2075	2002	646.71
3	A'	878	848	3.03
4	A'	648	626	334.84
5	A'	468	451	91.68
6	A"	502	485	1.55

Atom	x (Å)	y (Å)
N1	-0.152	1.688
C2	0.000	0.495
S3	0.035	-1.077
H4	0.501	2.452

	N1	C2	S3	H4
N1		1.2025	2.7713	1.0050
C2	1.2025		1.5726	2.0198
S3	2.7713	1.5726		3.5595
H4	1.0050	2.0198	3.5595

Number	Element	Mulliken
1	N	-0.494
2	C	0.395
3	S	-0.213
4	H	0.311

All results from a given calculation for HNCS (Isothiocyanic acid)

using model chemistry: G4

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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	x	y	z	Total
	1.084	1.830	0.000	2.127
CHELPG
AIM
ESP

<r²>	60.597
(<r²>)^1/2	7.784