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	hartrees
Energy at 0K	-7748.593590
Energy at 298.15K	-7748.603397
HF Energy	-7748.091922
Nuclear repulsion energy	803.672847

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3244	3070	2.21
2	A₁	546	517	1.31
3	A₁	229	216	0.02
4	E	1206	1141	32.65
4	E	1206	1141	32.65
5	E	686	650	71.13
5	E	686	650	71.14
6	E	163	154	0.02
6	E	163	154	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.541
H2	0.000	0.000	1.627
Br3	0.000	1.857	-0.046
Br4	1.608	-0.928	-0.046
Br5	-1.608	-0.928	-0.046

	C1	H2	Br3	Br4	Br5
C1		1.0861	1.9475	1.9475	1.9475
H2	1.0861		2.4998	2.4998	2.4998
Br3	1.9475	2.4998		3.2158	3.2158
Br4	1.9475	2.4998	3.2158		3.2158
Br5	1.9475	2.4998	3.2158	3.2158

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	107.567	H2	C1	Br4	107.567
H2	C1	Br5	107.567	Br3	C1	Br4	111.306
Br3	C1	Br5	111.306	Br4	C1	Br5	111.306

All results from a given calculation for CHBr₃ (bromoform)

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

States and conformations

All results from a given calculation for CHBr₃ (bromoform)