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	hartrees
Energy at 0K	-2612.303033
Energy at 298.15K
HF Energy	-2612.000303
Nuclear repulsion energy	88.795642

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3132	2969	17.57
2	A₁	1351	1281	24.34
3	A₁	639	605	9.27
4	E	3250	3080	3.13
4	E	3250	3080	3.13
5	E	1483	1405	4.85
5	E	1483	1405	4.85
6	E	977	926	4.83
6	E	977	926	4.83

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.524
Br2	0.000	0.000	0.421
H3	0.000	1.042	-1.867
H4	0.903	-0.521	-1.867
H5	-0.903	-0.521	-1.867

	C1	Br2	H3	H4	H5
C1		1.9449	1.0974	1.0974	1.0974
Br2	1.9449		2.5143	2.5143	2.5143
H3	1.0974	2.5143		1.8055	1.8055
H4	1.0974	2.5143	1.8055		1.8055
H5	1.0974	2.5143	1.8055	1.8055

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	H3	108.219	Br2	C1	H4	108.219
Br2	C1	H5	108.219	H3	C1	H4	110.694
H3	C1	H5	110.694	H4	C1	H5	110.694

All results from a given calculation for CH₃Br (methyl bromide)

using model chemistry: MP3/cc-pVDZ

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 CH3Br (methyl bromide)

using model chemistry: MP3/cc-pVDZ

States and conformations

All results from a given calculation for CH₃Br (methyl bromide)