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	hartrees
Energy at 0K	-2612.541873
Energy at 298.15K
HF Energy	-2612.092238
Nuclear repulsion energy	89.215802

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3086	2990
2	A₁	1339	1297
3	A₁	630	611
4	E	3196	3098
4	E	3196	3098
5	E	1483	1437
5	E	1482	1437
6	E	966	937
6	E	966	937

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.519
Br2	0.000	0.000	0.420
H3	0.000	1.032	-1.856
H4	0.894	-0.516	-1.856
H5	-0.894	-0.516	-1.856

	C1	Br2	H3	H4	H5
C1		1.9390	1.0853	1.0853	1.0853
Br2	1.9390		2.4985	2.4985	2.4985
H3	1.0853	2.4985		1.7872	1.7872
H4	1.0853	2.4985	1.7872		1.7872
H5	1.0853	2.4985	1.7872	1.7872

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	H3	108.063	Br2	C1	H4	108.063
Br2	C1	H5	108.063	H3	C1	H4	110.842
H3	C1	H5	110.842	H4	C1	H5	110.842

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

using model chemistry: MP4/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/cc-pVTZ

States and conformations

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