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	hartrees
Energy at 0K	-454.273552
Energy at 298.15K
HF Energy	-453.754822
Nuclear repulsion energy	58.154397

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3572	3419	11.73	103.44	0.08	0.15
2	A'	2730	2613	5.34	134.70	0.26	0.42
3	A'	1636	1566	14.03	4.19	0.60	0.75
4	A'	1060	1015	8.19	7.40	0.48	0.65
5	A'	893	854	32.56	5.40	0.31	0.48
6	A'	662	634	97.94	8.26	0.16	0.28
7	A"	3676	3519	34.43	41.20	0.75	0.86
8	A"	1142	1093	1.00	0.67	0.75	0.86
9	A"	444	425	47.12	2.32	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	0.015	1.098	0.000
S2	0.015	-0.612	0.000
H3	-1.309	-0.778	0.000
H4	0.483	1.444	0.821
H5	0.483	1.444	-0.821

	N1	S2	H3	H4	H5
N1		1.7095	2.2952	1.0063	1.0063
S2	1.7095		1.3341	2.2625	2.2625
H3	2.2952	1.3341		2.9694	2.9694
H4	1.0063	2.2625	2.9694		1.6421
H5	1.0063	2.2625	2.9694	1.6421

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	S2	H3	97.126		S2	N1	H4	110.124
S2	N1	H5	110.124		H4	N1	H5	109.350

All results from a given calculation for NH₂SH (Thiohydroxylamine)

using model chemistry: MP2=FULL/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: MP2=FULL/cc-pVQZ

States and conformations

All results from a given calculation for NH₂SH (Thiohydroxylamine)