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	hartrees
Energy at 0K	-423.688784
Energy at 298.15K
HF Energy	-423.688784
Nuclear repulsion energy	31.612576

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	2837	2717	22.19	74.40	0.21	0.35
2	Σ	1202	1151	53.69	72.78	0.08	0.14
3	Π	721	690	0.03	0.56	0.75	0.86
3	Π	721	690	0.03	0.56	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.116
H2	0.000	0.000	-2.295
S3	0.000	0.000	0.492

	B1	H2	S3
B1		1.1788	1.6078
H2	1.1788		2.7867
S3	1.6078	2.7867

Number	Element	Mulliken
1	B	-0.395
2	H	0.426
3	S	-0.031

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

using model chemistry: B1B95/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>	26.966
(<r²>)^1/2	5.193