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	hartrees
Energy at 0K	-7748.519308
Energy at 298.15K	-7748.529178
HF Energy	-7748.092348
Nuclear repulsion energy	807.768575

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3328	3074	3.07
2	A₁	561	518	1.42
3	A₁	235	217	0.02
4	E	1242	1147	36.68
4	E	1242	1147	36.68
5	E	712	658	77.48
5	E	712	658	77.48
6	E	168	155	0.02
6	E	168	155	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.538
H2	0.000	0.000	1.617
Br3	0.000	1.841	-0.046
Br4	1.594	-0.921	-0.046
Br5	-1.594	-0.921	-0.046

	C1	H2	Br3	Br4	Br5
C1		1.0784	1.9317	1.9317	1.9317
H2	1.0784		2.4810	2.4810	2.4810
Br3	1.9317	2.4810		3.1889	3.1889
Br4	1.9317	2.4810	3.1889		3.1889
Br5	1.9317	2.4810	3.1889	3.1889

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	107.616	H2	C1	Br4	107.616
H2	C1	Br5	107.616	Br3	C1	Br4	111.261
Br3	C1	Br5	111.261	Br4	C1	Br5	111.261

All results from a given calculation for CHBr₃ (bromoform)

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

States and conformations

All results from a given calculation for CHBr₃ (bromoform)