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	hartrees
Energy at 0K	-399.237742
Energy at 298.15K
HF Energy	-399.237742
Nuclear repulsion energy	12.803978

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2629	2629	0.04	149.35	0.10	0.18
2	A₁	1164	1164	0.16	8.48	0.75	0.86
3	B₂	2645	2645	0.01	75.32	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.105
H2	0.969	-0.837
H3	-0.969	-0.837

	S1	H2	H3
S1		1.3513	1.3513
H2	1.3513		1.9389
H3	1.3513	1.9389

Number	Element	Mulliken
1	S	-0.231
2	H	0.116
3	H	0.116

All results from a given calculation for H₂S (Hydrogen sulfide)

using model chemistry: PBEPBEultrafine/cc-pV(Q+d)Z

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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<r²>	12.301
(<r²>)^1/2	3.507

All results from a given calculation for H2S (Hydrogen sulfide)

using model chemistry: PBEPBEultrafine/cc-pV(Q+d)Z

States and conformations

All results from a given calculation for H₂S (Hydrogen sulfide)