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	hartrees
Energy at 0K	-454.078456
Energy at 298.15K
HF Energy	-453.715253
Nuclear repulsion energy	56.745513

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3504	3504	3.87
2	A'	2687	2687	8.53
3	A'	1626	1626	12.32
4	A'	1037	1037	15.47
5	A'	905	905	42.35
6	A'	677	677	39.98
7	A"	3600	3600	15.89
8	A"	1145	1145	0.17
9	A"	396	396	47.81

Atom	x (Å)	y (Å)	z (Å)
N1	0.012	1.134	0.000
S2	0.012	-0.630	0.000
H3	-1.335	-0.769	0.000
H4	0.525	1.453	0.823
H5	0.525	1.453	-0.823

	N1	S2	H3	H4	H5
N1		1.7639	2.3323	1.0201	1.0201
S2	1.7639		1.3548	2.2968	2.2968
H3	2.3323	1.3548		3.0122	3.0122
H4	1.0201	2.2968	3.0122		1.6452
H5	1.0201	2.2968	3.0122	1.6452

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	S2	H3	95.915		S2	N1	H4	108.182
S2	N1	H5	108.182		H4	N1	H5	107.490

All results from a given calculation for NH₂SH (Thiohydroxylamine)

using model chemistry: CCSD/daug-cc-pVDZ

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/daug-cc-pVDZ

States and conformations

All results from a given calculation for NH₂SH (Thiohydroxylamine)