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	hartrees
Energy at 0K	-454.206585
Energy at 298.15K
HF Energy	-453.754677
Nuclear repulsion energy	57.994960

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3570	3393	7.56
2	A'	2703	2569	8.10
3	A'	1654	1572	13.65
4	A'	1061	1008	9.91
5	A'	896	851	36.49
6	A'	676	643	88.35
7	A"	3662	3481	24.93
8	A"	1150	1093	0.71
9	A"	434	413	47.45

Atom	x (Å)	y (Å)	z (Å)
N1	0.015	1.101	0.000
S2	0.015	-0.614	0.000
H3	-1.313	-0.782	0.000
H4	0.486	1.446	0.821
H5	0.486	1.446	-0.821

	N1	S2	H3	H4	H5
N1		1.7149	2.3045	1.0072	1.0072
S2	1.7149		1.3389	2.2669	2.2669
H3	2.3045	1.3389		2.9794	2.9794
H4	1.0072	2.2669	2.9794		1.6412
H5	1.0072	2.2669	2.9794	1.6412

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	S2	H3	97.221		S2	N1	H4	110.035
S2	N1	H5	110.035		H4	N1	H5	109.115

All results from a given calculation for NH₂SH (Thiohydroxylamine)

using model chemistry: CCSD/cc-pVQZ

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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All results from a given calculation for NH2SH (Thiohydroxylamine)

using model chemistry: CCSD/cc-pVQZ

States and conformations

All results from a given calculation for NH₂SH (Thiohydroxylamine)