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	hartrees
Energy at 0K	-499.598367
Energy at 298.15K	-499.601349
HF Energy	-499.147898
Nuclear repulsion energy	51.526745

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3145	2933	20.92
2	A₁	1414	1319	11.82
3	A₁	771	719	22.61
4	E	3228	3010	4.61
4	E	3228	3010	4.61
5	E	1522	1419	5.48
5	E	1522	1419	5.48
6	E	1050	979	2.36
6	E	1050	979	2.36

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.123
Cl2	0.000	0.000	0.655
H3	0.000	1.023	-1.467
H4	0.886	-0.511	-1.467
H5	-0.886	-0.511	-1.467

	C1	Cl2	H3	H4	H5
C1		1.7786	1.0791	1.0791	1.0791
Cl2	1.7786		2.3558	2.3558	2.3558
H3	1.0791	2.3558		1.7718	1.7718
H4	1.0791	2.3558	1.7718		1.7718
H5	1.0791	2.3558	1.7718	1.7718

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.561	Cl2	C1	H4	108.561
Cl2	C1	H5	108.561	H3	C1	H4	110.366
H3	C1	H5	110.366	H4	C1	H5	110.366

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

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

using model chemistry: MP3=FULL/cc-pVTZ

States and conformations

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