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	hartrees
Energy at 0K	-2812.030840
Energy at 298.15K
HF Energy	-2811.680976
Nuclear repulsion energy	165.365567

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3021	2929
2	A₁	1184	1148
3	A₁	609	591
4	A₁	305	296
5	E	3106	3012
5	E	3106	3011
6	E	1460	1416
6	E	1460	1415
7	E	591	573
7	E	591	573
8	E	109	105
8	E	108	105

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-3.205
Mg2	0.000	0.000	-1.116
Br3	0.000	0.000	1.241
H4	0.000	1.023	-3.607
H5	0.886	-0.511	-3.607
H6	-0.886	-0.511	-3.607

	C1	Mg2	Br3	H4	H5	H6
C1		2.0888	4.4461	1.0990	1.0990	1.0990
Mg2	2.0888		2.3574	2.6930	2.6930	2.6930
Br3	4.4461	2.3574		4.9553	4.9553	4.9553
H4	1.0990	2.6930	4.9553		1.7713	1.7713
H5	1.0990	2.6930	4.9553	1.7713		1.7713
H6	1.0990	2.6930	4.9553	1.7713	1.7713

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Mg2	Br3	180.000	Mg2	C1	H4	111.482
Mg2	C1	H5	111.482	Mg2	C1	H6	111.482
H4	C1	H5	107.387	H4	C1	H6	107.387
H5	C1	H6	107.387

All results from a given calculation for CH₃MgBr (Methyl Magnesium Bromide)

using model chemistry: MP4/6-311G**

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 CH3MgBr (Methyl Magnesium Bromide)

using model chemistry: MP4/6-311G**

States and conformations

All results from a given calculation for CH₃MgBr (Methyl Magnesium Bromide)