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	hartrees
Energy at 0K	-423.515261
Energy at 298.15K
HF Energy	-423.515261
Nuclear repulsion energy	31.756729

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	2828	2718	22.26	68.53	0.17	0.29
2	Σ	1199	1153	55.76	56.35	0.15	0.26
3	Π	727	699	0.14	1.21	0.75	0.86
3	Π	727	699	0.14	1.21	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.111
H2	0.000	0.000	-2.284
S3	0.000	0.000	0.490

	B1	H2	S3
B1		1.1738	1.6005
H2	1.1738		2.7743
S3	1.6005	2.7743

Number	Element	Mulliken
1	B	0.017
2	H	0.043
3	S	-0.059

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

using model chemistry: HSEh1PBE/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>	26.793
(<r²>)^1/2	5.176