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	hartrees
Energy at 0K	-2599.607036
Energy at 298.15K
HF Energy	-2599.448408
Nuclear repulsion energy	86.187646

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3090	3024
2	A₁	1394	1365
3	A₁	576	564
4	E	3193	3126
4	E	3193	3125
5	E	1549	1516
5	E	1548	1515
6	E	971	951
6	E	971	951

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.586
Br2	0.000	0.000	0.436
H3	0.000	1.040	-1.915
H4	0.901	-0.520	-1.915
H5	-0.901	-0.520	-1.915

	C1	Br2	H3	H4	H5
C1		2.0217	1.0914	1.0914	1.0914
Br2	2.0217		2.5712	2.5712	2.5712
H3	1.0914	2.5712		1.8021	1.8021
H4	1.0914	2.5712	1.8021		1.8021
H5	1.0914	2.5712	1.8021	1.8021

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	H3	107.577	Br2	C1	H4	107.577
Br2	C1	H5	107.577	H3	C1	H4	111.297
H3	C1	H5	111.297	H4	C1	H5	111.297

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

using model chemistry: MP4=FULL/3-21G

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/3-21G

States and conformations

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