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	hartrees
Energy at 0K	-399.432262
Energy at 298.15K	-399.433366
HF Energy	-399.432262
Nuclear repulsion energy	12.864149

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	2681	2594	0.17	170.63	0.07	0.13
2	A₁	1206	1167	0.49	4.50	0.69	0.82
3	B₂	2695	2607	0.00	69.84	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.103
H2	0.973	-0.825
H3	-0.973	-0.825

	S1	H2	H3
S1		1.3448	1.3448
H2	1.3448		1.9454
H3	1.3448	1.9454

Number	Element	Mulliken
1	S	-0.232
2	H	0.116
3	H	0.116

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

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

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>	12.353
(<r²>)^1/2	3.515

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

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

States and conformations

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