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	hartrees
Energy at 0K	-499.495191
Energy at 298.15K	-499.498179
HF Energy	-499.125726
Nuclear repulsion energy	51.317188

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3123	3123	25.15
2	A₁	1456	1456	12.96
3	A₁	775	775	23.55
4	E	3225	3225	7.74
4	E	3225	3225	7.74
5	E	1519	1519	6.45
5	E	1519	1519	6.45
6	E	1075	1075	6.85
6	E	1075	1075	6.85

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.126
Cl2	0.000	0.000	0.658
H3	0.000	1.029	-1.475
H4	0.891	-0.515	-1.475
H5	-0.891	-0.515	-1.475

	C1	Cl2	H3	H4	H5
C1		1.7833	1.0870	1.0870	1.0870
Cl2	1.7833		2.3683	2.3683	2.3683
H3	1.0870	2.3683		1.7826	1.7826
H4	1.0870	2.3683	1.7826		1.7826
H5	1.0870	2.3683	1.7826	1.7826

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.769	Cl2	C1	H4	108.769
Cl2	C1	H5	108.769	H3	C1	H4	110.164
H3	C1	H5	110.164	H4	C1	H5	110.164

All results from a given calculation for CH₃Cl (Methyl chloride)

using model chemistry: MP3=FULL/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 CH3Cl (Methyl chloride)

using model chemistry: MP3=FULL/6-311G*

States and conformations

All results from a given calculation for CH₃Cl (Methyl chloride)