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	hartrees
Energy at 0K	-7748.598879
Energy at 298.15K	-7748.608665
HF Energy	-7748.091780
Nuclear repulsion energy	802.571338

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3237	3083	1.98
2	A₁	542	516	1.34
3	A₁	227	216	0.02
4	E	1197	1140	34.90
4	E	1197	1140	34.90
5	E	676	644	78.30
5	E	676	644	78.31
6	E	162	154	0.01
6	E	162	154	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.543
H2	0.000	0.000	1.629
Br3	0.000	1.860	-0.047
Br4	1.611	-0.930	-0.047
Br5	-1.611	-0.930	-0.047

	C1	H2	Br3	Br4	Br5
C1		1.0863	1.9511	1.9511	1.9511
H2	1.0863		2.5034	2.5034	2.5034
Br3	1.9511	2.5034		3.2216	3.2216
Br4	1.9511	2.5034	3.2216		3.2216
Br5	1.9511	2.5034	3.2216	3.2216

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	107.578	H2	C1	Br4	107.578
H2	C1	Br5	107.578	Br3	C1	Br4	111.297
Br3	C1	Br5	111.297	Br4	C1	Br5	111.297

All results from a given calculation for CHBr₃ (bromoform)

using model chemistry: QCISD/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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All results from a given calculation for CHBr3 (bromoform)

using model chemistry: QCISD/6-31G*

States and conformations

All results from a given calculation for CHBr₃ (bromoform)