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	hartrees
Energy at 0K	-499.552299
Energy at 298.15K	-499.555278
HF Energy	-499.148822
Nuclear repulsion energy	51.444879

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3123	3123	21.17
2	A₁	1405	1405	12.29
3	A₁	766	766	23.24
4	E	3224	3224	4.92
4	E	3224	3224	4.92
5	E	1509	1509	5.27
5	E	1509	1509	5.27
6	E	1046	1046	2.28
6	E	1046	1046	2.28

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.124
Cl2	0.000	0.000	0.656
H3	0.000	1.026	-1.469
H4	0.889	-0.513	-1.469
H5	-0.889	-0.513	-1.469

	C1	Cl2	H3	H4	H5
C1		1.7802	1.0828	1.0828	1.0828
Cl2	1.7802		2.3601	2.3601	2.3601
H3	1.0828	2.3601		1.7778	1.7778
H4	1.0828	2.3601	1.7778		1.7778
H5	1.0828	2.3601	1.7778	1.7778

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.581	Cl2	C1	H4	108.581
Cl2	C1	H5	108.581	H3	C1	H4	110.347
H3	C1	H5	110.347	H4	C1	H5	110.347

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

using model chemistry: MP3/cc-pV(T+d)Z

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/cc-pV(T+d)Z

States and conformations

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