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	hartrees
Energy at 0K	-1398.632300
Energy at 298.15K	-1398.632479
HF Energy	-1398.632300
Nuclear repulsion energy	226.008075

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	446	429	0.00
2	A₂"	460	443	10.21
3	E'	902	867	343.85
3	E'	902	867	343.84
4	E'	262	252	1.52
4	E'	262	252	1.52

Atom	x (Å)	y (Å)
B1	0.000	0.000
Cl2	0.000	1.769
Cl3	1.532	-0.885
Cl4	-1.532	-0.885

	B1	Cl2	Cl3	Cl4
B1		1.7691	1.7691	1.7691
Cl2	1.7691		3.0641	3.0641
Cl3	1.7691	3.0641		3.0641
Cl4	1.7691	3.0641	3.0641

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	B1	Cl3	120.000		Cl2	B1	Cl4	120.000
Cl3	B1	Cl4	120.000

All results from a given calculation for BCl₃ (Borane, trichloro-)

using model chemistry: B3PW91/3-21G

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	0.019
2	Cl	-0.006
3	Cl	-0.006
4	Cl	-0.006

<r²>	187.602
(<r²>)^1/2	13.697

All results from a given calculation for BCl3 (Borane, trichloro-)

using model chemistry: B3PW91/3-21G

States and conformations

All results from a given calculation for BCl₃ (Borane, trichloro-)