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	hartrees
Energy at 0K	-1389.698402
Energy at 298.15K	-1389.698502
HF Energy	-1389.673165
Nuclear repulsion energy	225.034536

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁'	499	499	0.00	6.55	0.10	0.19
2	A₂"	453	453	38.28	0.00	0.75	0.86
3	E'	1079	1079	307.27	0.00	0.75	0.86
3	E'	1079	1079	307.27	0.00	0.75	0.86
4	E'	263	263	3.85	3.33	0.75	0.86
4	E'	263	263	3.85	3.33	0.75	0.86

Atom	x (Å)	y (Å)
B1	0.000	0.000
Cl2	0.000	1.777
Cl3	1.539	-0.888
Cl4	-1.539	-0.888

	B1	Cl2	Cl3	Cl4
B1		1.7767	1.7767	1.7767
Cl2	1.7767		3.0774	3.0774
Cl3	1.7767	3.0774		3.0774
Cl4	1.7767	3.0774	3.0774

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: B2PLYP=FULL/STO-3G

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

using model chemistry: B2PLYP=FULL/STO-3G

States and conformations

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