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	hartrees
Energy at 0K	-423.643038
Energy at 298.15K
HF Energy	-423.643038
Nuclear repulsion energy	31.562130

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	2818	2698	24.34	71.14	0.20	0.34
2	Σ	1204	1153	63.51	71.74	0.08	0.14
3	Π	731	700	0.07	0.80	0.75	0.86
3	Π	731	700	0.07	0.80	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.117
H2	0.000	0.000	-2.299
S3	0.000	0.000	0.493

	B1	H2	S3
B1		1.1815	1.6103
H2	1.1815		2.7918
S3	1.6103	2.7918

Number	Element	Mulliken
1	B	-0.419
2	H	0.416
3	S	0.003

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

using model chemistry: wB97X-D/aug-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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<r²>	27.015
(<r²>)^1/2	5.198