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	hartrees
Energy at 0K	-423.624063
Energy at 298.15K
HF Energy	-423.624063
Nuclear repulsion energy	31.642187

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	2858	2858	23.76	76.43	0.22	0.36
2	Σ	1211	1211	65.06	75.14	0.07	0.14
3	Π	733	733	0.03	0.90	0.75	0.86
3	Π	733	733	0.03	0.90	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.115
H2	0.000	0.000	-2.293
S3	0.000	0.000	0.492

	B1	H2	S3
B1		1.1783	1.6062
H2	1.1783		2.7845
S3	1.6062	2.7845

Number	Element	Mulliken
1	B	-0.427
2	H	0.392
3	S	0.036

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

using model chemistry: M06-2X/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>	26.987
(<r²>)^1/2	5.195