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	hartrees
Energy at 0K	-2612.602266
Energy at 298.15K
HF Energy	-2612.092342
Nuclear repulsion energy	89.445902

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3106	2991
2	A₁	1347	1297
3	A₁	633	610
4	E	3197	3078
4	E	3196	3078
5	E	1493	1438
5	E	1493	1438
6	E	967	931
6	E	967	931

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.516
Br2	0.000	0.000	0.419
H3	0.000	1.028	-1.852
H4	0.890	-0.514	-1.852
H5	-0.890	-0.514	-1.852

	C1	Br2	H3	H4	H5
C1		1.9342	1.0817	1.0817	1.0817
Br2	1.9342		2.4921	2.4921	2.4921
H3	1.0817	2.4921		1.7810	1.7810
H4	1.0817	2.4921	1.7810		1.7810
H5	1.0817	2.4921	1.7810	1.7810

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	H3	108.092	Br2	C1	H4	108.092
Br2	C1	H5	108.092	H3	C1	H4	110.814
H3	C1	H5	110.814	H4	C1	H5	110.814

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

using model chemistry: MP4=FULL/cc-pVTZ

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: MP4=FULL/cc-pVTZ

States and conformations

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