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	hartrees
Energy at 0K	-945.466839
Energy at 298.15K	-945.467797
Nuclear repulsion energy	110.797336

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2666	2630	74.73
2	A₁	724	715	29.84
3	A₁	290	286	0.88
4	B₁	757	747	10.50
5	B₂	1076	1061	209.31
6	B₂	890	878	193.82

Atom	y (Å)	z (Å)
B1	0.000	0.703
H2	0.000	1.898
Cl3	1.524	-0.159
Cl4	-1.524	-0.159

	B1	H2	Cl3	Cl4
B1		1.1945	1.7510	1.7510
H2	1.1945		2.5598	2.5598
Cl3	1.7510	2.5598		3.0479
Cl4	1.7510	2.5598	3.0479

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	B1	Cl3	119.503		H2	B1	Cl4	119.503
Cl3	B1	Cl4	120.993

All results from a given calculation for BHCl₂ (Borane, dichloro-)

using model chemistry: PBEPBE/6-31G**

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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Number	Element	Mulliken
1	B	0.039
2	H	0.041
3	Cl	-0.040
4	Cl	-0.040

	x	y	z	Total
	0.000	0.000	0.471	0.471
CHELPG
AIM
ESP

<r²>	105.329
(<r²>)^1/2	10.263

All results from a given calculation for BHCl2 (Borane, dichloro-)

using model chemistry: PBEPBE/6-31G**

States and conformations

All results from a given calculation for BHCl₂ (Borane, dichloro-)