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	hartrees
Energy at 0K	-423.647834
Energy at 298.15K
HF Energy	-423.647834
Nuclear repulsion energy	31.874133

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	2868	2868	26.44	70.28	0.23	0.37
2	Σ	1215	1215	69.22	80.42	0.07	0.12
3	Π	741	741	0.20	1.11	0.75	0.86
3	Π	741	741	0.20	1.11	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.107
H2	0.000	0.000	-2.275
S3	0.000	0.000	0.488

	B1	H2	S3
B1		1.1688	1.5947
H2	1.1688		2.7635
S3	1.5947	2.7635

Number	Element	Mulliken
1	B	0.202
2	H	-0.369
3	S	0.167

All results from a given calculation for HBS (hydrogen boron sulfide)

using model chemistry: M06-2X/daug-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>	26.730
(<r²>)^1/2	5.170